#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ztt h TRP 25 N 0.00 0.00 0.41 4.78 4.06 -2.01 -2.47 115.95 120.71 1ztt h TRP 25 Ca 0.00 0.00 -0.02 0.00 2.06 0.00 0.00 58.89 60.93 1ztt h TRP 25 Cb 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.16 1ztt h TRP 25 CO 0.00 0.15 -0.20 1.25 -3.56 0.00 0.00 178.44 176.09 1ztt h LEU 26 N 0.00 -0.46 -1.03 -4.49 5.85 -2.00 -3.16 115.31 110.01 1ztt h LEU 26 Ca -0.00 -0.12 -0.02 0.00 0.84 0.00 0.00 57.88 58.59 1ztt h LEU 26 Cb 0.29 0.12 -0.00 0.00 0.37 0.00 0.00 40.66 41.43 1ztt h LEU 26 CO 0.02 -0.10 -0.07 0.77 -0.34 0.00 0.00 178.44 178.72 1ztt h SER 27 N -0.89 0.00 1.41 1.25 4.64 -2.00 -3.15 113.55 114.82 1ztt h SER 27 Ca -0.06 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.21 1ztt h SER 27 Cb 0.55 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.64 1ztt h SER 27 CO 0.09 0.07 -0.25 0.44 -0.87 0.00 0.00 176.83 176.31 1ztt h ASP 28 N 0.00 0.00 -2.07 4.97 3.45 -1.50 -3.37 116.42 117.90 1ztt h ASP 28 Ca -0.00 0.00 -0.55 0.00 0.43 0.00 0.00 57.03 56.91 1ztt h ASP 28 Cb 0.70 0.00 -0.40 0.00 -0.56 0.00 0.00 39.33 39.07 1ztt h ASP 28 CO 0.01 0.25 -0.99 0.49 -1.57 0.00 0.00 179.24 177.44 1ztt n PHE 29 N -3.24 1.06 -0.29 4.55 3.72 -1.19 -4.96 117.46 117.11 1ztt n PHE 29 Ca 0.02 -3.80 0.05 0.00 -0.05 0.00 0.00 57.45 53.67 1ztt n PHE 29 Cb 0.56 -0.43 0.20 0.00 -0.94 0.00 0.00 39.48 38.87 1ztt n PHE 29 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 1ztt h PRO 30 N 3.59 0.66 -0.03 -1.08 0.11 -1.74 -2.47 132.00 131.05 1ztt h PRO 30 Ca 0.11 -0.04 -0.13 0.00 0.11 0.00 0.00 66.00 66.05 1ztt h PRO 30 Cb 0.82 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.77 1ztt h PRO 30 CO 0.58 0.44 -0.58 0.37 -0.21 0.00 0.00 178.00 178.60 1ztt h GLN 31 N 0.68 0.11 0.00 1.05 4.15 -1.92 -2.35 115.11 116.83 1ztt h GLN 31 Ca 0.43 -0.07 -0.11 0.00 0.77 0.00 0.00 58.65 59.67 1ztt h GLN 31 Cb 0.53 0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.22 1ztt h GLN 31 CO -0.32 0.66 -0.53 0.00 -1.93 0.00 0.00 178.83 176.71 1ztt h ALA 32 N 1.32 0.98 -2.73 3.38 0.00 -1.69 -3.40 119.26 117.12 1ztt h ALA 32 Ca -0.00 -0.49 -0.59 0.00 0.00 0.00 0.00 54.91 53.83 1ztt h ALA 32 Cb 1.05 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.70 1ztt h ALA 32 CO 0.08 0.67 -0.14 -1.58 0.00 0.00 0.00 179.25 178.28 1ztt s TRP 33 N -3.60 3.71 0.38 0.00 0.52 -1.19 -0.65 118.94 118.10 1ztt s TRP 33 Ca -0.01 1.06 0.07 0.00 0.02 0.00 0.00 56.10 57.25 1ztt s TRP 33 Cb 0.12 -2.41 0.76 0.00 -1.15 0.00 0.00 33.47 30.79 1ztt s TRP 33 CO 0.74 0.53 1.95 0.00 0.02 0.00 0.00 176.95 180.19 1ztt h ALA 34 N 5.08 1.54 0.00 0.98 0.00 -1.04 0.54 119.26 126.35 1ztt h ALA 34 Ca -0.49 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.25 1ztt h ALA 34 Cb 1.21 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.87 1ztt h ALA 34 CO 0.65 0.34 -0.11 0.93 0.00 0.00 0.00 179.25 181.06 1ztt h GLU 35 N 0.41 0.00 0.00 0.00 3.07 -1.93 -3.33 114.58 112.80 1ztt h GLU 35 Ca 0.10 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.96 1ztt h GLU 35 Cb 0.22 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.13 1ztt h GLU 35 CO 0.00 0.11 0.00 0.25 -1.40 0.00 0.00 179.01 177.97 1ztt n THR 36 N -3.88 0.00 0.61 1.13 -2.24 -0.90 -4.82 114.28 104.19 1ztt n THR 36 Ca -0.02 -0.27 0.12 0.00 -2.27 0.00 0.00 64.05 61.61 1ztt n THR 36 Cb 0.21 1.06 0.20 0.00 -2.10 0.00 0.00 70.33 69.70 1ztt n THR 36 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ztt n GLY 37 N 0.47 1.37 0.33 3.38 0.00 0.18 -4.72 105.19 106.20 1ztt n GLY 37 Ca 0.00 -0.70 0.04 0.00 0.00 0.00 0.00 46.02 45.36 1ztt n GLY 37 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ztt n GLY 38 N 1.43 -2.08 3.77 -0.02 0.00 -1.26 -4.83 105.19 102.20 1ztt n GLY 38 Ca 0.18 -1.41 -0.41 0.00 0.00 0.00 0.00 46.02 44.37 1ztt n GLY 38 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1ztt s MET 39 N -2.25 4.09 0.95 1.61 1.75 -1.26 -4.84 119.30 119.36 1ztt s MET 39 Ca 0.00 2.60 -0.15 0.00 -1.25 0.00 0.00 55.69 56.90 1ztt s MET 39 Cb 0.00 -2.98 0.17 0.00 2.84 0.00 0.00 34.83 34.86 1ztt s MET 39 CO 0.00 -0.59 1.20 0.20 -0.65 0.00 0.00 175.02 175.18 1ztt s GLY 40 N 0.08 1.65 -0.30 2.11 0.00 -1.26 -5.07 107.32 104.53 1ztt s GLY 40 Ca 0.56 -0.85 -0.14 0.00 0.00 0.00 0.00 44.72 44.30 1ztt s GLY 40 CO 0.59 -0.18 1.01 -2.27 0.00 0.00 0.00 173.10 172.26 1ztt s LEU 41 N -6.04 -0.54 -1.03 0.66 0.20 0.39 -4.57 118.68 107.75 1ztt s LEU 41 Ca 0.68 0.54 -0.23 0.00 0.69 0.00 0.00 54.13 55.81 1ztt s LEU 41 Cb -0.10 1.53 0.01 0.00 -0.43 0.00 0.00 46.19 47.21 1ztt s LEU 41 CO 0.53 -0.10 1.67 0.00 -0.29 0.00 0.00 176.35 178.16 1ztt s ALA 42 N 2.64 2.39 0.62 5.97 0.00 0.94 -4.12 121.76 130.19 1ztt s ALA 42 Ca -0.00 -2.10 0.34 0.00 0.00 0.00 0.00 51.96 50.20 1ztt s ALA 42 Cb -0.08 -4.56 1.98 0.00 0.00 0.00 0.00 23.12 20.46 1ztt s ALA 42 CO -0.15 -4.07 2.26 -0.39 0.00 0.00 0.00 175.76 173.42 1ztt h VAL 43 N 6.76 0.35 0.00 0.00 -1.51 -1.82 -2.53 116.25 117.50 1ztt h VAL 43 Ca 0.20 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.67 1ztt h VAL 43 Cb 0.99 0.97 0.00 0.00 -2.13 0.00 0.00 31.29 31.12 1ztt h VAL 43 CO 1.35 0.00 -0.49 0.54 -1.23 0.00 0.00 177.57 177.74 1ztt n ARG 44 N -3.59 0.10 -3.49 5.19 5.12 -1.26 -4.86 116.66 113.88 1ztt n ARG 44 Ca -0.02 0.03 -0.37 0.00 -1.93 0.00 0.00 57.85 55.56 1ztt n ARG 44 Cb 0.12 -1.57 -0.07 0.00 -1.16 0.00 0.00 32.46 29.78 1ztt n ARG 44 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 1ztt s GLN 45 N -3.06 4.22 0.42 5.56 -1.52 -0.95 -5.06 119.66 119.27 1ztt s GLN 45 Ca 0.10 0.11 -0.25 0.00 -1.95 0.00 0.00 55.36 53.37 1ztt s GLN 45 Cb 0.16 -3.48 -0.08 0.00 -0.22 0.00 0.00 33.01 29.40 1ztt s GLN 45 CO 0.69 0.12 1.25 0.00 -0.25 0.00 0.00 175.29 177.10 1ztt s ALA 46 N 0.82 3.16 0.22 6.09 0.00 -1.26 -4.82 121.76 125.98 1ztt s ALA 46 Ca 0.17 1.13 -0.32 0.00 0.00 0.00 0.00 51.96 52.95 1ztt s ALA 46 Cb -0.14 -3.45 -0.14 0.00 0.00 0.00 0.00 23.12 19.39 1ztt s ALA 46 CO 0.06 -0.77 1.39 -2.30 0.00 0.00 0.00 175.76 174.14 1ztt n PRO 47 N -0.04 1.92 -2.49 0.00 -0.02 -1.26 -4.85 135.00 128.27 1ztt n PRO 47 Ca 0.05 0.69 -0.41 0.00 -2.02 0.00 0.00 63.50 61.80 1ztt n PRO 47 Cb 0.45 -2.33 -0.04 0.00 -0.02 0.00 0.00 33.50 31.56 1ztt n PRO 47 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1ztt s LEU 48 N 0.24 4.45 -0.19 2.45 1.43 -0.41 -4.26 118.68 122.38 1ztt s LEU 48 Ca 0.70 2.06 -0.07 0.00 -1.03 0.00 0.00 54.13 55.79 1ztt s LEU 48 Cb -0.68 -3.60 -0.04 0.00 0.03 0.00 0.00 46.19 41.90 1ztt s LEU 48 CO 0.49 -0.30 0.06 -0.63 0.23 0.00 0.00 176.35 176.20 1ztt s ILE 49 N 0.17 4.69 -0.49 -0.59 1.01 -1.26 -0.05 121.20 124.68 1ztt s ILE 49 Ca 0.52 -0.07 -0.11 0.00 0.00 0.00 0.00 60.65 60.99 1ztt s ILE 49 Cb -0.29 -3.12 0.12 0.00 0.01 0.00 0.00 42.46 39.17 1ztt s ILE 49 CO 0.33 0.44 0.38 -0.63 0.00 0.00 0.00 174.94 175.47 1ztt s ILE 50 N 0.58 4.55 0.22 2.92 -1.09 -1.26 -5.05 121.20 122.08 1ztt s ILE 50 Ca 0.03 -1.63 -0.30 0.00 -2.23 0.00 0.00 60.65 56.52 1ztt s ILE 50 Cb -0.13 -3.94 -0.10 0.00 -1.58 0.00 0.00 42.46 36.72 1ztt s ILE 50 CO 0.01 -0.77 1.40 -2.84 -1.23 0.00 0.00 174.94 171.52 1ztt s PRO 51 N 1.45 4.30 0.40 2.79 0.02 -1.26 -4.97 135.00 137.73 1ztt s PRO 51 Ca 0.05 2.22 -0.01 0.00 0.02 0.00 0.00 61.00 63.27 1ztt s PRO 51 Cb -0.27 -3.15 -0.03 0.00 0.02 0.00 0.00 34.50 31.07 1ztt s PRO 51 CO 0.01 -0.38 0.63 -0.51 -0.33 0.00 0.00 177.00 176.42 1ztt s LEU 52 N -0.12 3.87 0.75 -5.54 1.43 -1.26 -1.49 118.68 116.31 1ztt s LEU 52 Ca 0.59 0.59 -0.13 0.00 -1.03 0.00 0.00 54.13 54.15 1ztt s LEU 52 Cb -0.40 -3.48 0.05 0.00 0.03 0.00 0.00 46.19 42.39 1ztt s LEU 52 CO 0.40 -0.41 1.14 -0.54 0.23 0.00 0.00 176.35 177.17 1ztt s LYS 53 N -4.47 2.18 0.57 1.70 1.02 -0.39 -4.40 119.74 115.95 1ztt s LYS 53 Ca 0.43 1.49 0.27 0.00 0.02 0.00 0.00 55.97 58.17 1ztt s LYS 53 Cb -0.10 -1.87 1.58 0.00 -0.52 0.00 0.00 37.83 36.92 1ztt s LYS 53 CO 0.39 -1.75 2.10 0.00 -0.92 0.00 0.00 175.35 175.17 1ztt h ALA 54 N -0.63 1.92 -0.15 5.17 0.00 -1.97 -2.68 119.26 120.93 1ztt h ALA 54 Ca -0.46 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1ztt h ALA 54 Cb 1.26 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1ztt h ALA 54 CO 0.50 -0.30 0.00 0.25 0.00 0.00 0.00 179.25 179.70 1ztt n THR 55 N -3.99 0.24 -2.18 0.00 -2.24 -1.26 -5.02 114.28 99.83 1ztt n THR 55 Ca 0.02 -0.62 -0.39 0.00 -2.27 0.00 0.00 64.05 60.79 1ztt n THR 55 Cb 0.33 1.16 -0.02 0.00 -2.10 0.00 0.00 70.33 69.70 1ztt n THR 55 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1ztt s SER 56 N -1.36 6.57 0.05 3.42 0.01 -1.01 -5.05 113.70 116.32 1ztt s SER 56 Ca 0.25 2.53 0.03 0.00 1.31 0.00 0.00 55.95 60.07 1ztt s SER 56 Cb 0.16 -2.63 -0.02 0.00 0.21 0.00 0.00 66.02 63.73 1ztt s SER 56 CO 0.23 -0.66 -0.09 0.28 0.41 0.00 0.00 173.24 173.42 1ztt s THR 57 N -1.27 0.61 0.53 1.44 -1.32 -1.26 -4.97 115.64 109.40 1ztt s THR 57 Ca 0.54 -1.12 -0.20 0.00 -1.21 0.00 0.00 61.69 59.69 1ztt s THR 57 Cb -0.36 -0.68 -0.07 0.00 -1.51 0.00 0.00 72.50 69.87 1ztt s THR 57 CO 0.46 -0.37 0.92 -2.65 -2.21 0.00 0.00 174.62 170.76 1ztt n PRO 58 N 1.41 1.01 -4.82 7.08 -0.02 -1.26 -5.02 135.00 133.39 1ztt n PRO 58 Ca -0.22 0.38 -0.26 0.00 -2.02 0.00 0.00 63.50 61.37 1ztt n PRO 58 Cb 0.55 -2.06 -0.16 0.00 -0.02 0.00 0.00 33.50 31.81 1ztt n PRO 58 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1ztt s VAL 59 N -1.46 1.43 -0.33 -1.45 0.11 -1.26 -4.96 120.40 112.48 1ztt s VAL 59 Ca 0.70 -0.69 0.04 0.00 -2.93 0.00 0.00 61.98 59.10 1ztt s VAL 59 Cb -0.47 -1.25 0.10 0.00 -1.53 0.00 0.00 36.38 33.23 1ztt s VAL 59 CO 0.52 0.42 0.03 -0.55 -3.33 0.00 0.00 175.10 172.19 1ztt s SER 60 N 0.26 4.75 -0.11 3.54 0.15 -1.25 -1.67 113.70 119.36 1ztt s SER 60 Ca -0.09 -2.06 -0.17 0.00 0.70 0.00 0.00 55.95 54.32 1ztt s SER 60 Cb -0.14 -1.63 -0.04 0.00 -1.71 0.00 0.00 66.02 62.50 1ztt s SER 60 CO 0.04 -0.36 0.45 -0.63 1.20 0.00 0.00 173.24 173.93 1ztt s ILE 61 N 0.93 5.19 0.37 6.45 1.01 0.85 -4.89 121.20 131.11 1ztt s ILE 61 Ca 0.09 0.89 -0.28 0.00 0.00 0.00 0.00 60.65 61.35 1ztt s ILE 61 Cb -0.19 -3.79 -0.10 0.00 0.01 0.00 0.00 42.46 38.39 1ztt s ILE 61 CO -0.08 0.36 1.38 -0.54 0.00 0.00 0.00 174.94 176.06 1ztt s LYS 62 N 0.46 4.15 -0.31 2.79 1.02 -1.26 -4.35 119.74 122.24 1ztt s LYS 62 Ca 0.25 2.34 -0.28 0.00 0.02 0.00 0.00 55.97 58.30 1ztt s LYS 62 Cb -0.15 -2.95 0.01 0.00 -0.52 0.00 0.00 37.83 34.23 1ztt s LYS 62 CO 0.10 -0.41 1.03 -1.14 -0.92 0.00 0.00 175.35 174.01 1ztt s GLN 63 N -2.03 4.07 0.23 1.68 2.00 -1.26 -4.71 119.66 119.64 1ztt s GLN 63 Ca 0.52 1.02 -0.30 0.00 -2.00 0.00 0.00 55.36 54.61 1ztt s GLN 63 Cb -0.42 -3.73 -0.09 0.00 0.80 0.00 0.00 33.01 29.57 1ztt s GLN 63 CO 0.56 -0.85 1.35 1.52 -0.50 0.00 0.00 175.29 177.38 1ztt s TYR 64 N 3.51 3.16 -0.09 1.67 -0.85 -1.26 -4.87 117.35 118.62 1ztt s TYR 64 Ca 0.43 1.17 -0.41 0.00 -0.52 0.00 0.00 57.07 57.75 1ztt s TYR 64 Cb -0.13 -3.68 -0.19 0.00 0.38 0.00 0.00 41.96 38.34 1ztt s TYR 64 CO 0.14 -2.15 1.25 -2.30 -1.52 0.00 0.00 175.55 170.98 1ztt n PRO 65 N 2.34 0.27 -4.05 -3.49 -0.02 -1.26 -4.95 135.00 123.85 1ztt n PRO 65 Ca 0.06 0.10 -0.36 0.00 -2.02 0.00 0.00 63.50 61.28 1ztt n PRO 65 Cb 0.42 -1.64 -0.08 0.00 -0.02 0.00 0.00 33.50 32.18 1ztt n PRO 65 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 1ztt s MET 66 N 0.82 3.52 0.80 -0.52 1.75 -1.26 -5.09 119.30 119.32 1ztt s MET 66 Ca 0.93 -0.28 -0.11 0.00 -1.25 0.00 0.00 55.69 54.98 1ztt s MET 66 Cb -1.24 -3.10 0.08 0.00 2.84 0.00 0.00 34.83 33.40 1ztt s MET 66 CO 0.60 0.58 1.12 -1.54 -0.65 0.00 0.00 175.02 175.13 1ztt s SER 67 N -0.48 4.07 0.27 1.11 1.04 -1.26 -4.81 113.70 113.64 1ztt s SER 67 Ca 0.10 2.01 -0.02 0.00 0.48 0.00 0.00 55.95 58.52 1ztt s SER 67 Cb -0.12 -2.55 0.37 0.00 0.10 0.00 0.00 66.02 63.83 1ztt s SER 67 CO 0.02 -2.33 1.85 -0.61 0.98 0.00 0.00 173.24 173.14 1ztt h GLN 68 N -1.14 0.94 -0.42 4.02 4.15 -1.98 -1.41 115.11 119.26 1ztt h GLN 68 Ca -0.44 -0.16 0.05 0.00 0.77 0.00 0.00 58.65 58.87 1ztt h GLN 68 Cb 1.25 -0.16 -0.04 0.00 0.21 0.00 0.00 27.48 28.74 1ztt h GLN 68 CO 0.49 0.78 0.17 1.49 -1.93 0.00 0.00 178.83 179.82 1ztt h GLU 69 N 0.92 0.33 -0.30 1.69 4.81 -1.99 0.97 114.58 121.01 1ztt h GLU 69 Ca 0.21 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.39 1ztt h GLU 69 Cb 0.20 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.49 1ztt h GLU 69 CO -0.02 0.22 0.05 0.00 -0.73 0.00 0.00 179.01 178.54 1ztt h ALA 70 N 1.26 0.40 -0.68 2.92 0.00 -1.83 -1.77 119.26 119.56 1ztt h ALA 70 Ca 0.19 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 54.94 1ztt h ALA 70 Cb 0.16 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 1ztt h ALA 70 CO -0.18 0.08 0.43 -0.09 0.00 0.00 0.00 179.25 179.48 1ztt h ARG 71 N 0.32 0.81 -0.32 0.00 2.43 -0.84 -0.50 114.38 116.29 1ztt h ARG 71 Ca 0.09 -0.05 -0.09 0.00 -0.81 0.00 0.00 59.98 59.12 1ztt h ARG 71 Cb 0.33 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.68 1ztt h ARG 71 CO 0.00 0.54 -0.17 -0.07 -1.51 0.00 0.00 179.97 178.76 1ztt h LEU 72 N 0.84 0.57 -0.67 3.80 4.07 -0.71 0.20 115.31 123.42 1ztt h LEU 72 Ca 0.27 -0.17 -0.13 0.00 0.08 0.00 0.00 57.88 57.93 1ztt h LEU 72 Cb 0.00 -0.15 -0.01 0.00 1.08 0.00 0.00 40.66 41.58 1ztt h LEU 72 CO -0.10 0.76 -0.35 1.23 -1.08 0.00 0.00 178.44 178.90 1ztt h GLY 73 N 0.98 0.70 1.57 0.83 0.00 -0.60 -3.26 103.07 103.27 1ztt h GLY 73 Ca 0.09 -0.66 -0.28 0.00 0.00 0.00 0.00 47.33 46.47 1ztt h GLY 73 CO 0.04 0.60 -1.29 -2.22 0.00 0.00 0.00 176.54 173.67 1ztt h ILE 74 N 0.54 1.45 -0.89 2.60 2.04 -0.88 -3.39 117.51 118.97 1ztt h ILE 74 Ca 0.06 -3.01 0.18 0.00 1.00 0.00 0.00 64.86 63.08 1ztt h ILE 74 Cb 0.86 2.94 -0.17 0.00 -0.74 0.00 0.00 36.82 39.71 1ztt h ILE 74 CO 0.07 0.88 -0.23 0.50 0.00 0.00 0.00 178.15 179.37 1ztt h LYS 75 N 0.08 -0.00 -0.97 2.37 3.64 -1.00 -1.16 116.57 119.53 1ztt h LYS 75 Ca -0.15 0.00 0.08 0.00 -1.27 0.00 0.00 60.65 59.31 1ztt h LYS 75 Cb 2.00 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 33.75 1ztt h LYS 75 CO 0.21 -0.00 0.62 -1.35 -2.27 0.00 0.00 179.45 176.66 1ztt h PRO 76 N -0.00 1.03 -0.36 1.90 0.11 -1.76 -1.42 132.00 131.50 1ztt h PRO 76 Ca 0.42 -0.06 -0.10 0.00 0.11 0.00 0.00 66.00 66.37 1ztt h PRO 76 Cb 0.65 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 31.52 1ztt h PRO 76 CO -0.92 0.68 -0.18 0.45 -0.21 0.00 0.00 178.00 177.83 1ztt h HIS 77 N 1.06 0.88 -0.65 0.65 3.86 -1.49 -2.00 115.15 117.47 1ztt h HIS 77 Ca 0.44 -0.22 -0.02 0.00 -1.16 0.00 0.00 60.37 59.41 1ztt h HIS 77 Cb 0.28 -0.20 -0.03 0.00 1.06 0.00 0.00 27.41 28.52 1ztt h HIS 77 CO -0.00 0.95 0.34 0.82 0.86 0.00 0.00 177.93 180.90 1ztt h ILE 78 N 0.55 1.21 -0.55 2.45 1.08 -1.02 -1.17 117.51 120.06 1ztt h ILE 78 Ca 0.08 -0.55 -0.06 0.00 -0.39 0.00 0.00 64.86 63.94 1ztt h ILE 78 Cb 0.72 0.39 -0.02 0.00 -3.07 0.00 0.00 36.82 34.84 1ztt h ILE 78 CO 0.05 0.23 0.11 -0.61 -0.69 0.00 0.00 178.15 177.25 1ztt h GLN 79 N 0.88 0.89 -0.45 2.37 5.75 -1.20 0.23 115.11 123.58 1ztt h GLN 79 Ca 0.23 -0.23 -0.01 0.00 -0.15 0.00 0.00 58.65 58.49 1ztt h GLN 79 Cb 0.07 -0.11 -0.02 0.00 1.07 0.00 0.00 27.48 28.48 1ztt h GLN 79 CO -0.03 0.85 0.24 -0.09 -2.65 0.00 0.00 178.83 177.14 1ztt h ARG 80 N 0.78 0.63 -0.34 1.69 2.43 -1.10 0.15 114.38 118.62 1ztt h ARG 80 Ca 0.17 -0.08 -0.07 0.00 -0.81 0.00 0.00 59.98 59.19 1ztt h ARG 80 Cb 0.37 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.78 1ztt h ARG 80 CO 0.01 0.50 -0.10 -0.07 -1.51 0.00 0.00 179.97 178.80 1ztt h LEU 81 N 0.58 0.55 -0.30 3.80 3.38 -1.01 0.77 115.31 123.09 1ztt h LEU 81 Ca 0.16 -0.14 -0.09 0.00 0.09 0.00 0.00 57.88 57.89 1ztt h LEU 81 Cb 0.06 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1ztt h LEU 81 CO -0.02 0.69 -0.17 -0.07 0.09 0.00 0.00 178.44 178.96 1ztt h LEU 82 N 0.53 0.67 -1.13 1.67 3.38 -0.48 0.45 115.31 120.41 1ztt h LEU 82 Ca 0.10 -0.42 -0.04 0.00 0.09 0.00 0.00 57.88 57.61 1ztt h LEU 82 Cb 0.49 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.03 1ztt h LEU 82 CO 0.03 0.95 0.20 0.44 0.09 0.00 0.00 178.44 180.15 1ztt h ASP 83 N 0.40 0.75 0.65 -0.43 3.32 -0.31 -1.42 116.42 119.37 1ztt h ASP 83 Ca 0.06 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 57.01 1ztt h ASP 83 Cb 0.71 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 40.06 1ztt h ASP 83 CO 0.05 0.69 0.00 0.00 -1.72 0.00 0.00 179.24 178.26 1ztt n GLN 84 N -4.32 0.24 -0.98 3.56 6.02 0.23 -4.89 117.38 117.24 1ztt n GLN 84 Ca 0.04 0.04 0.00 0.00 -0.01 0.00 0.00 57.00 57.08 1ztt n GLN 84 Cb 0.18 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 29.94 1ztt n GLN 84 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1ztt n GLY 85 N 1.04 0.54 0.12 1.08 0.00 -0.54 -4.88 105.19 102.55 1ztt n GLY 85 Ca 0.10 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.10 1ztt n GLY 85 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1ztt h ILE 86 N 0.00 1.45 -4.06 -0.61 2.04 -1.18 -3.43 117.51 111.71 1ztt h ILE 86 Ca 0.00 -2.50 -0.69 0.00 1.00 0.00 0.00 64.86 62.67 1ztt h ILE 86 Cb 0.10 2.37 -0.23 0.00 -0.74 0.00 0.00 36.82 38.32 1ztt h ILE 86 CO 0.00 0.70 -0.81 -0.76 0.00 0.00 0.00 178.15 177.28 1ztt s LEU 87 N -7.20 2.54 0.02 1.44 1.43 -0.92 -1.32 118.68 114.67 1ztt s LEU 87 Ca -0.00 -0.41 -0.06 0.00 -1.03 0.00 0.00 54.13 52.62 1ztt s LEU 87 Cb 0.11 -1.49 -0.00 0.00 0.03 0.00 0.00 46.19 44.84 1ztt s LEU 87 CO 0.77 0.27 0.12 0.68 0.23 0.00 0.00 176.35 178.43 1ztt s VAL 88 N -0.86 0.10 0.71 -1.59 -7.23 -0.52 -4.38 120.40 106.63 1ztt s VAL 88 Ca 0.13 -0.84 -0.15 0.00 -1.81 0.00 0.00 61.98 59.31 1ztt s VAL 88 Cb -0.10 -0.59 0.03 0.00 0.56 0.00 0.00 36.38 36.27 1ztt s VAL 88 CO 0.04 -0.46 1.19 -2.84 -0.31 0.00 0.00 175.10 172.71 1ztt s PRO 89 N -1.84 2.29 0.07 4.82 0.02 -1.26 -0.97 135.00 138.13 1ztt s PRO 89 Ca -0.11 1.70 -0.27 0.00 0.02 0.00 0.00 61.00 62.33 1ztt s PRO 89 Cb -0.05 -1.86 0.09 0.00 0.02 0.00 0.00 34.50 32.69 1ztt s PRO 89 CO -0.01 -1.70 0.98 0.00 -0.33 0.00 0.00 177.00 175.94 1ztt s GLN 91 N -3.10 1.47 0.05 0.00 -0.21 -1.26 -3.69 119.66 112.92 1ztt s GLN 91 Ca 0.10 -0.89 0.04 0.00 0.02 0.00 0.00 55.36 54.63 1ztt s GLN 91 Cb -0.01 -2.50 -0.02 0.00 1.00 0.00 0.00 33.01 31.48 1ztt s GLN 91 CO -0.02 -0.60 -0.12 0.45 -2.12 0.00 0.00 175.29 172.88 1ztt s SER 92 N 1.47 1.40 0.13 5.90 0.15 -1.26 -5.00 113.70 116.49 1ztt s SER 92 Ca -0.05 -0.50 0.22 0.00 0.70 0.00 0.00 55.95 56.33 1ztt s SER 92 Cb -0.18 -0.05 0.88 0.00 -1.71 0.00 0.00 66.02 64.95 1ztt s SER 92 CO -0.06 -0.05 1.68 -0.81 1.20 0.00 0.00 173.24 175.20 1ztt n PRO 93 N 1.70 0.12 -3.82 5.44 -0.04 -1.26 -4.69 135.00 132.44 1ztt n PRO 93 Ca -0.20 0.27 -0.33 0.00 -0.04 0.00 0.00 63.50 63.20 1ztt n PRO 93 Cb 0.55 -1.69 -0.05 0.00 -0.04 0.00 0.00 33.50 32.27 1ztt n PRO 93 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1ztt s TRP 94 N -3.13 3.55 -0.29 0.54 0.52 -1.26 -3.91 118.94 114.96 1ztt s TRP 94 Ca 0.08 0.45 -0.16 0.00 0.02 0.00 0.00 56.10 56.49 1ztt s TRP 94 Cb 0.11 -1.90 0.11 0.00 -1.15 0.00 0.00 33.47 30.64 1ztt s TRP 94 CO 0.41 0.60 0.80 1.21 0.02 0.00 0.00 176.95 179.99 1ztt s ASN 95 N -1.97 -0.80 0.12 2.95 2.47 -0.67 -4.47 114.94 112.57 1ztt s ASN 95 Ca 0.30 1.26 0.06 0.00 0.42 0.00 0.00 52.86 54.90 1ztt s ASN 95 Cb -0.13 1.41 -0.04 0.00 -1.45 0.00 0.00 41.25 41.04 1ztt s ASN 95 CO 0.19 -0.20 -0.15 0.42 -3.72 0.00 0.00 177.10 173.65 1ztt s THR 96 N 1.66 1.40 0.49 -5.21 -4.23 -0.84 -0.11 115.64 108.81 1ztt s THR 96 Ca -0.09 -1.71 -0.23 0.00 -1.18 0.00 0.00 61.69 58.49 1ztt s THR 96 Cb -0.05 -1.54 -0.06 0.00 1.34 0.00 0.00 72.50 72.18 1ztt s THR 96 CO -0.18 -0.37 1.24 -2.84 -0.54 0.00 0.00 174.62 171.93 1ztt s PRO 97 N -2.59 3.53 -0.11 3.99 0.02 -1.26 -4.44 135.00 134.15 1ztt s PRO 97 Ca 0.09 1.97 -0.01 0.00 0.02 0.00 0.00 61.00 63.07 1ztt s PRO 97 Cb -0.06 -2.36 -0.03 0.00 0.02 0.00 0.00 34.50 32.07 1ztt s PRO 97 CO 0.03 -0.79 -0.07 -1.17 -0.33 0.00 0.00 177.00 174.67 1ztt s LEU 98 N -3.19 3.12 0.14 -5.54 2.96 -1.26 -1.14 118.68 113.77 1ztt s LEU 98 Ca 0.66 -0.10 0.10 0.00 -0.22 0.00 0.00 54.13 54.57 1ztt s LEU 98 Cb -0.33 -1.71 -0.04 0.00 0.50 0.00 0.00 46.19 44.61 1ztt s LEU 98 CO 0.40 0.27 -0.20 -1.48 -1.32 0.00 0.00 176.35 174.02 1ztt s LEU 99 N -0.25 2.60 -0.75 -0.68 2.34 0.19 -4.84 118.68 117.30 1ztt s LEU 99 Ca 0.03 -0.67 -0.26 0.00 0.06 0.00 0.00 54.13 53.29 1ztt s LEU 99 Cb -0.13 -1.41 0.01 0.00 -0.56 0.00 0.00 46.19 44.10 1ztt s LEU 99 CO 0.03 0.16 1.50 -2.84 -1.06 0.00 0.00 176.35 174.13 1ztt s PRO 100 N -2.33 3.04 0.11 1.48 0.02 -1.26 -3.74 135.00 132.32 1ztt s PRO 100 Ca 0.19 -0.11 0.04 0.00 0.02 0.00 0.00 61.00 61.13 1ztt s PRO 100 Cb -0.10 -4.43 -0.04 0.00 0.02 0.00 0.00 34.50 29.95 1ztt s PRO 100 CO 0.10 -2.39 0.08 0.08 -0.33 0.00 0.00 177.00 174.53 1ztt s VAL 101 N 6.84 4.38 -0.32 3.83 1.01 -1.26 -5.02 120.40 129.86 1ztt s VAL 101 Ca 0.47 -0.94 0.04 0.00 0.00 0.00 0.00 61.98 61.55 1ztt s VAL 101 Cb -0.08 -3.15 0.27 0.00 0.00 0.00 0.00 36.38 33.42 1ztt s VAL 101 CO 0.13 0.04 1.35 2.29 0.00 0.00 0.00 175.10 178.90 1ztt n LYS 102 N 0.20 0.12 0.00 2.72 2.85 -1.26 -3.78 118.16 119.01 1ztt n LYS 102 Ca -0.09 -0.66 0.00 0.00 -1.05 0.00 0.00 58.31 56.51 1ztt n LYS 102 Cb 0.53 -0.10 0.00 0.00 -0.65 0.00 0.00 35.03 34.81 1ztt n LYS 102 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 1ztt n LYS 103 N 0.29 0.00 0.00 -1.58 4.01 -1.26 -2.09 118.16 117.53 1ztt n LYS 103 Ca -0.11 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.69 1ztt n LYS 103 Cb 0.74 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 35.26 1ztt n LYS 103 CO 0.00 0.00 0.00 -2.30 -1.11 0.00 0.00 177.40 173.99 1ztt n PRO 104 N -2.51 0.00 0.00 1.97 -0.02 -1.26 -4.99 135.00 128.18 1ztt n PRO 104 Ca 0.00 0.04 0.00 0.00 -2.02 0.00 0.00 63.50 61.52 1ztt n PRO 104 Cb 0.00 -0.70 0.00 0.00 -0.02 0.00 0.00 33.50 32.78 1ztt n PRO 104 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ztt n GLY 105 N -0.25 1.03 3.45 -1.23 0.00 -0.89 -5.11 105.19 102.20 1ztt n GLY 105 Ca 0.00 -0.07 -0.43 0.00 0.00 0.00 0.00 46.02 45.51 1ztt n GLY 105 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ztt s THR 106 N 0.00 5.24 0.00 2.61 2.01 -1.26 -4.99 115.64 119.25 1ztt s THR 106 Ca 0.00 -0.72 0.00 0.00 0.31 0.00 0.00 61.69 61.28 1ztt s THR 106 Cb 0.00 -3.98 0.00 0.00 0.01 0.00 0.00 72.50 68.53 1ztt s THR 106 CO 0.00 -0.38 0.00 0.59 -0.69 0.00 0.00 174.62 174.14 1ztt n ASN 107 N 5.21 0.00 -3.05 3.53 4.13 -1.26 -4.98 115.26 118.84 1ztt n ASN 107 Ca -0.11 0.00 -0.16 0.00 1.68 0.00 0.00 54.58 55.99 1ztt n ASN 107 Cb 0.46 0.00 0.02 0.00 -1.54 0.00 0.00 39.78 38.72 1ztt n ASN 107 CO 0.00 0.00 0.00 -0.90 0.28 0.00 0.00 177.26 176.64 1ztt n ASP 108 N 3.34 -5.39 -4.78 6.41 5.75 -1.26 -4.80 116.55 115.81 1ztt n ASP 108 Ca 0.00 0.13 -0.25 0.00 -0.01 0.00 0.00 54.79 54.66 1ztt n ASP 108 Cb 0.00 -1.40 -0.05 0.00 -1.03 0.00 0.00 41.12 38.63 1ztt n ASP 108 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 1ztt s TYR 109 N -1.07 3.08 -0.27 2.11 1.51 -1.26 -4.29 117.35 117.15 1ztt s TYR 109 Ca 0.16 -0.07 -0.21 0.00 -1.01 0.00 0.00 57.07 55.94 1ztt s TYR 109 Cb -0.02 -1.44 0.08 0.00 -0.11 0.00 0.00 41.96 40.47 1ztt s TYR 109 CO 0.36 0.53 0.71 -0.98 -1.11 0.00 0.00 175.55 175.06 1ztt s ARG 110 N -3.34 0.77 -0.02 -0.62 1.70 -1.25 -4.84 118.95 111.35 1ztt s ARG 110 Ca 0.31 1.09 -0.30 0.00 -0.47 0.00 0.00 55.73 56.36 1ztt s ARG 110 Cb -0.09 0.28 -0.05 0.00 -0.57 0.00 0.00 34.95 34.52 1ztt s ARG 110 CO 0.23 -0.12 1.44 -2.14 -1.08 0.00 0.00 175.30 173.63 1ztt s PRO 111 N 0.96 4.26 -0.14 3.89 0.02 -1.26 -4.16 135.00 138.56 1ztt s PRO 111 Ca -0.05 1.99 0.01 0.00 0.02 0.00 0.00 61.00 62.97 1ztt s PRO 111 Cb -0.05 -3.65 0.02 0.00 0.02 0.00 0.00 34.50 30.84 1ztt s PRO 111 CO -0.09 -0.63 -0.15 0.08 -0.33 0.00 0.00 177.00 175.87 1ztt s VAL 112 N 2.73 1.63 -0.13 3.83 1.01 -1.25 -5.02 120.40 123.21 1ztt s VAL 112 Ca 0.65 -0.69 -0.12 0.00 0.00 0.00 0.00 61.98 61.83 1ztt s VAL 112 Cb -0.31 -1.51 -0.05 0.00 0.00 0.00 0.00 36.38 34.51 1ztt s VAL 112 CO 0.26 0.47 0.25 -1.58 0.00 0.00 0.00 175.10 174.50 1ztt s GLN 113 N 1.32 3.98 -0.80 2.72 0.74 -1.26 -0.64 119.66 125.72 1ztt s GLN 113 Ca 0.02 0.05 -0.20 0.00 0.05 0.00 0.00 55.36 55.28 1ztt s GLN 113 Cb -0.13 -3.33 0.11 0.00 1.10 0.00 0.00 33.01 30.76 1ztt s GLN 113 CO -0.08 0.47 1.02 0.34 -0.55 0.00 0.00 175.29 176.48 1ztt s ASP 114 N -0.21 6.44 -0.10 6.67 2.15 -0.29 -4.83 116.67 126.50 1ztt s ASP 114 Ca 0.16 -1.66 0.12 0.00 0.43 0.00 0.00 52.55 51.60 1ztt s ASP 114 Cb -0.13 -2.39 0.53 0.00 -0.30 0.00 0.00 42.92 40.63 1ztt s ASP 114 CO 0.05 -1.17 1.37 0.18 -0.17 0.00 0.00 175.17 175.43 1ztt n LEU 115 N 6.81 3.68 -0.36 -1.34 4.77 -1.26 -4.30 117.00 125.01 1ztt n LEU 115 Ca 0.11 -1.86 0.05 0.00 -0.03 0.00 0.00 56.01 54.28 1ztt n LEU 115 Cb 0.47 -0.51 0.21 0.00 -2.33 0.00 0.00 43.42 41.26 1ztt n LEU 115 CO 0.55 0.59 1.25 0.03 -1.33 0.00 0.00 177.39 178.48 1ztt h ARG 116 N 2.88 1.05 0.00 3.23 3.08 -1.89 0.21 114.38 122.94 1ztt h ARG 116 Ca 0.00 -0.06 -0.05 0.00 0.07 0.00 0.00 59.98 59.93 1ztt h ARG 116 Cb 1.19 -0.24 -0.01 0.00 0.08 0.00 0.00 29.97 31.00 1ztt h ARG 116 CO 0.20 0.70 -0.26 0.93 -1.07 0.00 0.00 179.97 180.48 1ztt h GLU 117 N 1.08 0.00 0.06 0.04 4.39 -2.00 -1.76 114.58 116.40 1ztt h GLU 117 Ca 0.45 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 60.06 1ztt h GLU 117 Cb 0.31 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.97 1ztt h GLU 117 CO -0.21 0.26 -0.42 0.28 -1.16 0.00 0.00 179.01 177.76 1ztt h VAL 118 N 0.00 1.63 -0.81 3.13 2.07 -1.59 -3.27 116.25 117.41 1ztt h VAL 118 Ca -0.00 -2.38 0.13 0.00 0.82 0.00 0.00 66.70 65.27 1ztt h VAL 118 Cb 0.81 3.21 -0.09 0.00 -1.52 0.00 0.00 31.29 33.70 1ztt h VAL 118 CO 0.03 0.65 0.41 0.78 0.02 0.00 0.00 177.57 179.47 1ztt h ASN 119 N -0.62 0.51 0.21 0.57 2.35 -0.45 0.33 115.58 118.47 1ztt h ASN 119 Ca -0.07 0.08 -0.01 0.00 -0.55 0.00 0.00 56.30 55.75 1ztt h ASN 119 Cb 1.31 -0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.67 1ztt h ASN 119 CO 0.08 0.24 -0.04 0.11 -1.65 0.00 0.00 177.43 176.17 1ztt h LYS 120 N 0.63 0.00 -0.03 0.81 1.57 -1.42 -2.48 116.57 115.65 1ztt h LYS 120 Ca 0.43 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.21 1ztt h LYS 120 Cb 0.56 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.87 1ztt h LYS 120 CO -0.33 0.04 -0.05 0.54 -0.57 0.00 0.00 179.45 179.08 1ztt n ARG 121 N -3.48 2.15 -3.69 3.15 1.74 0.06 -4.93 116.66 111.66 1ztt n ARG 121 Ca -0.02 -1.80 -0.37 0.00 -0.77 0.00 0.00 57.85 54.89 1ztt n ARG 121 Cb 0.15 -1.45 -0.07 0.00 -1.02 0.00 0.00 32.46 30.07 1ztt n ARG 121 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1ztt s VAL 122 N -2.01 5.34 0.30 1.55 1.01 -0.94 -1.26 120.40 124.40 1ztt s VAL 122 Ca 0.26 0.43 -0.30 0.00 0.00 0.00 0.00 61.98 62.37 1ztt s VAL 122 Cb 0.19 -3.53 -0.12 0.00 0.00 0.00 0.00 36.38 32.92 1ztt s VAL 122 CO 0.32 0.53 1.50 1.21 0.00 0.00 0.00 175.10 178.66 1ztt n GLU 123 N 2.54 2.48 -2.39 2.72 4.07 -0.55 -4.64 120.64 124.87 1ztt n GLU 123 Ca -0.16 0.88 -0.35 0.00 -0.06 0.00 0.00 57.16 57.47 1ztt n GLU 123 Cb 0.53 -2.60 -0.02 0.00 -0.06 0.00 0.00 31.44 29.29 1ztt n GLU 123 CO 0.00 0.00 0.00 -0.51 -0.06 0.00 0.00 177.13 176.56 1ztt s ASP 124 N 0.27 6.06 0.15 4.31 1.01 -1.26 -4.95 116.67 122.26 1ztt s ASP 124 Ca 0.62 2.08 0.08 0.00 0.71 0.00 0.00 52.55 56.04 1ztt s ASP 124 Cb -0.54 -2.57 -0.04 0.00 1.01 0.00 0.00 42.92 40.78 1ztt s ASP 124 CO 0.53 -0.98 -0.18 0.27 0.21 0.00 0.00 175.17 175.01 1ztt s ILE 125 N -1.83 1.76 0.26 0.77 -4.36 -1.26 -5.11 121.20 111.42 1ztt s ILE 125 Ca 0.69 -1.83 -0.30 0.00 -0.26 0.00 0.00 60.65 58.95 1ztt s ILE 125 Cb -0.21 -1.76 -0.10 0.00 1.25 0.00 0.00 42.46 41.63 1ztt s ILE 125 CO 0.25 -0.27 1.51 -2.28 0.24 0.00 0.00 174.94 174.38 1ztt s HIS 126 N -1.87 2.93 -0.73 1.37 5.65 -1.26 -4.91 115.29 116.47 1ztt s HIS 126 Ca 0.13 0.90 -0.26 0.00 0.25 0.00 0.00 55.06 56.08 1ztt s HIS 126 Cb -0.07 -3.92 0.01 0.00 -1.18 0.00 0.00 32.58 27.43 1ztt s HIS 126 CO 0.06 -3.06 1.57 -2.14 -0.65 0.00 0.00 174.74 170.51 1ztt s PRO 127 N -0.26 2.96 0.00 2.88 0.02 -1.26 -4.84 135.00 134.50 1ztt s PRO 127 Ca 0.62 -0.01 0.25 0.00 0.02 0.00 0.00 61.00 61.88 1ztt s PRO 127 Cb -0.44 -4.44 0.43 0.00 0.02 0.00 0.00 34.50 30.07 1ztt s PRO 127 CO 0.44 -2.47 1.36 0.25 -0.33 0.00 0.00 177.00 176.24 1ztt n THR 128 N 6.86 0.00 -2.40 0.99 -2.24 -1.26 -4.87 114.28 111.35 1ztt n THR 128 Ca 0.15 -0.06 -0.43 0.00 -2.27 0.00 0.00 64.05 61.45 1ztt n THR 128 Cb 0.50 0.48 -0.02 0.00 -2.10 0.00 0.00 70.33 69.19 1ztt n THR 128 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1ztt s VAL 129 N -2.81 4.18 0.62 2.28 1.01 -1.26 -5.00 120.40 119.42 1ztt s VAL 129 Ca 0.15 1.48 -0.16 0.00 0.00 0.00 0.00 61.98 63.45 1ztt s VAL 129 Cb 0.18 -3.95 -0.02 0.00 0.00 0.00 0.00 36.38 32.59 1ztt s VAL 129 CO 0.66 -0.07 1.10 -2.16 0.00 0.00 0.00 175.10 174.63 1ztt s PRO 130 N 2.93 3.02 0.44 2.72 0.04 -1.26 -5.00 135.00 137.89 1ztt s PRO 130 Ca 0.57 1.39 -0.22 0.00 0.04 0.00 0.00 61.00 62.78 1ztt s PRO 130 Cb -0.24 -1.98 -0.09 0.00 0.04 0.00 0.00 34.50 32.22 1ztt s PRO 130 CO 0.19 -1.07 1.00 0.54 0.04 0.00 0.00 177.00 177.70 1ztt s ASN 131 N -2.47 6.69 0.30 6.66 2.20 -1.26 -4.82 114.94 122.24 1ztt s ASN 131 Ca 0.67 1.87 0.04 0.00 -0.94 0.00 0.00 52.86 54.49 1ztt s ASN 131 Cb -0.20 -2.56 0.77 0.00 -2.00 0.00 0.00 41.25 37.26 1ztt s ASN 131 CO 0.38 -0.54 1.63 -0.65 -2.94 0.00 0.00 177.10 174.97 1ztt h PRO 132 N 1.97 0.15 -0.05 3.55 0.11 -1.97 -1.16 132.00 134.60 1ztt h PRO 132 Ca -0.49 -0.01 0.03 0.00 0.11 0.00 0.00 66.00 65.65 1ztt h PRO 132 Cb 1.20 -0.03 -0.04 0.00 0.11 0.00 0.00 31.00 32.24 1ztt h PRO 132 CO 0.61 0.10 -0.22 -0.92 -0.21 0.00 0.00 178.00 177.36 1ztt h TYR 133 N 0.15 -0.57 -0.56 0.65 5.03 -1.98 -0.89 116.97 118.81 1ztt h TYR 133 Ca 0.59 0.02 -0.10 0.00 2.58 0.00 0.00 58.73 61.81 1ztt h TYR 133 Cb 1.23 0.26 -0.02 0.00 1.55 0.00 0.00 36.73 39.75 1ztt h TYR 133 CO -0.29 -0.30 -0.06 -0.91 -1.32 0.00 0.00 178.16 175.28 1ztt h ASN 134 N -0.32 1.01 -0.66 -2.11 2.35 -1.73 -2.97 115.58 111.16 1ztt h ASN 134 Ca 0.07 -0.33 0.08 0.00 -0.55 0.00 0.00 56.30 55.58 1ztt h ASN 134 Cb 0.42 -0.27 -0.07 0.00 0.05 0.00 0.00 38.32 38.45 1ztt h ASN 134 CO -0.23 1.10 0.31 0.25 -1.65 0.00 0.00 177.43 177.22 1ztt h LEU 135 N 0.90 0.40 -1.40 1.61 5.85 -0.78 -0.89 115.31 121.01 1ztt h LEU 135 Ca 0.15 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.93 1ztt h LEU 135 Cb 0.62 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.64 1ztt h LEU 135 CO 0.04 0.24 0.00 -0.07 -0.34 0.00 0.00 178.44 178.31 1ztt h LEU 136 N 0.55 0.00 -1.06 2.25 -0.00 -1.03 -2.62 115.31 113.40 1ztt h LEU 136 Ca 0.32 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.20 1ztt h LEU 136 Cb 0.33 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.99 1ztt h LEU 136 CO -0.26 0.00 0.00 -1.54 -0.00 0.00 0.00 178.44 176.64 1ztt n SER 137 N -2.90 0.60 -1.13 -0.43 3.41 -0.34 -1.43 113.62 111.40 1ztt n SER 137 Ca 0.01 0.71 0.05 0.00 -0.26 0.00 0.00 58.87 59.38 1ztt n SER 137 Cb 0.27 -0.82 0.22 0.00 -0.26 0.00 0.00 64.21 63.63 1ztt n SER 137 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ztt n GLY 138 N -0.68 1.88 3.28 5.00 0.00 -0.99 -4.76 105.19 108.92 1ztt n GLY 138 Ca 0.00 -0.52 -0.43 0.00 0.00 0.00 0.00 46.02 45.07 1ztt n GLY 138 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ztt s LEU 139 N -1.39 5.76 0.32 0.99 0.20 -0.52 -5.00 118.68 119.03 1ztt s LEU 139 Ca 0.31 -1.70 -0.28 0.00 0.69 0.00 0.00 54.13 53.15 1ztt s LEU 139 Cb 0.21 -2.10 -0.09 0.00 -0.43 0.00 0.00 46.19 43.77 1ztt s LEU 139 CO 0.13 -0.71 1.14 -2.84 -0.29 0.00 0.00 176.35 173.78 1ztt s PRO 140 N 1.50 4.47 0.65 0.98 0.02 -1.26 -4.94 135.00 136.42 1ztt s PRO 140 Ca 0.04 1.85 0.41 0.00 0.02 0.00 0.00 61.00 63.32 1ztt s PRO 140 Cb -0.27 -3.04 2.26 0.00 0.02 0.00 0.00 34.50 33.48 1ztt s PRO 140 CO 0.02 0.04 2.32 -1.35 -0.33 0.00 0.00 177.00 177.70 1ztt h PRO 141 N 3.45 0.00 0.00 5.54 0.11 -1.98 -1.09 132.00 138.03 1ztt h PRO 141 Ca -0.48 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.63 1ztt h PRO 141 Cb 1.22 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 1ztt h PRO 141 CO 0.66 0.00 -0.02 0.66 -0.21 0.00 0.00 178.00 179.08 1ztt h SER 142 N 0.00 0.00 -3.71 -2.05 4.64 -1.97 -3.38 113.55 107.08 1ztt h SER 142 Ca 0.00 0.00 -0.71 0.00 -0.47 0.00 0.00 61.79 60.61 1ztt h SER 142 Cb 0.06 0.00 -0.33 0.00 -0.31 0.00 0.00 62.40 61.82 1ztt h SER 142 CO -0.00 0.02 -0.39 -1.00 -0.87 0.00 0.00 176.83 174.59 1ztt s HIS 143 N -3.69 3.50 -0.38 4.77 3.76 -0.41 -4.37 115.29 118.47 1ztt s HIS 143 Ca 0.01 -2.37 0.12 0.00 -0.15 0.00 0.00 55.06 52.67 1ztt s HIS 143 Cb 0.09 -3.33 0.31 0.00 1.11 0.00 0.00 32.58 30.77 1ztt s HIS 143 CO 0.55 -0.93 1.24 1.04 -0.85 0.00 0.00 174.74 175.79 1ztt n GLN 144 N 4.21 2.64 -3.86 1.40 6.02 -1.02 -4.69 117.38 122.08 1ztt n GLN 144 Ca 0.01 -2.28 -0.36 0.00 -0.01 0.00 0.00 57.00 54.37 1ztt n GLN 144 Cb 0.40 -1.43 -0.14 0.00 1.02 0.00 0.00 30.24 30.10 1ztt n GLN 144 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 1ztt s TRP 145 N -1.89 3.04 0.27 1.08 0.52 -0.80 -4.45 118.94 116.71 1ztt s TRP 145 Ca 0.26 -0.99 0.12 0.00 0.02 0.00 0.00 56.10 55.50 1ztt s TRP 145 Cb 0.19 -2.15 -0.05 0.00 -1.15 0.00 0.00 33.47 30.31 1ztt s TRP 145 CO 0.08 -0.56 -0.20 0.71 0.02 0.00 0.00 176.95 177.00 1ztt s TYR 146 N 1.47 2.24 -0.03 -1.98 1.51 0.10 -0.59 117.35 120.07 1ztt s TYR 146 Ca 0.04 -0.35 -0.00 0.00 -1.01 0.00 0.00 57.07 55.75 1ztt s TYR 146 Cb -0.15 -0.98 0.03 0.00 -0.11 0.00 0.00 41.96 40.74 1ztt s TYR 146 CO -0.01 0.68 0.02 0.99 -1.11 0.00 0.00 175.55 176.12 1ztt s THR 147 N -2.50 0.02 -0.10 -0.71 2.01 -0.40 -0.35 115.64 113.60 1ztt s THR 147 Ca 0.29 0.20 0.04 0.00 0.31 0.00 0.00 61.69 62.53 1ztt s THR 147 Cb -0.05 -0.16 -0.00 0.00 0.01 0.00 0.00 72.50 72.30 1ztt s THR 147 CO 0.14 0.12 -0.24 -0.69 -0.69 0.00 0.00 174.62 173.27 1ztt s VAL 148 N 1.22 2.10 0.04 3.82 1.01 0.37 -0.42 120.40 128.54 1ztt s VAL 148 Ca -0.07 -1.01 0.03 0.00 0.00 0.00 0.00 61.98 60.93 1ztt s VAL 148 Cb -0.13 -1.80 -0.02 0.00 0.00 0.00 0.00 36.38 34.43 1ztt s VAL 148 CO -0.03 0.56 -0.11 -0.76 0.00 0.00 0.00 175.10 174.77 1ztt s LEU 149 N 0.27 2.18 -0.08 3.92 1.43 -0.56 -1.84 118.68 124.00 1ztt s LEU 149 Ca -0.17 -0.44 0.03 0.00 -1.03 0.00 0.00 54.13 52.53 1ztt s LEU 149 Cb -0.17 -0.40 0.01 0.00 0.03 0.00 0.00 46.19 45.66 1ztt s LEU 149 CO 0.08 -0.05 -0.17 1.51 0.23 0.00 0.00 176.35 177.95 1ztt s ASP 150 N -1.16 2.34 0.07 2.29 -4.77 -1.26 -0.45 116.67 113.74 1ztt s ASP 150 Ca -0.02 -0.41 -0.29 0.00 -3.30 0.00 0.00 52.55 48.52 1ztt s ASP 150 Cb -0.08 -1.05 -0.05 0.00 -1.09 0.00 0.00 42.92 40.66 1ztt s ASP 150 CO 0.01 0.09 0.95 -0.76 0.70 0.00 0.00 175.17 176.16 1ztt s LEU 151 N 0.48 4.45 0.09 2.11 1.43 0.11 -1.37 118.68 125.99 1ztt s LEU 151 Ca -0.16 1.71 -0.26 0.00 -1.03 0.00 0.00 54.13 54.40 1ztt s LEU 151 Cb -0.16 -3.54 -0.06 0.00 0.03 0.00 0.00 46.19 42.45 1ztt s LEU 151 CO 0.06 -0.12 0.79 -0.75 0.23 0.00 0.00 176.35 176.56 1ztt s LYS 152 N 0.33 4.54 -1.46 1.70 2.47 0.17 -4.03 119.74 123.46 1ztt s LYS 152 Ca 0.48 1.14 -0.00 0.00 -1.56 0.00 0.00 55.97 56.02 1ztt s LYS 152 Cb -0.22 -3.33 0.00 0.00 -1.46 0.00 0.00 37.83 32.82 1ztt s LYS 152 CO 0.28 0.38 0.27 -0.25 0.16 0.00 0.00 175.35 176.19 1ztt n ASP 153 N 2.38 0.13 0.08 1.43 8.00 -1.26 -4.62 116.55 122.69 1ztt n ASP 153 Ca -0.03 -1.11 -0.12 0.00 0.71 0.00 0.00 54.79 54.24 1ztt n ASP 153 Cb 0.50 -2.51 -0.05 0.00 -0.02 0.00 0.00 41.12 39.04 1ztt n ASP 153 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ztt h ALA 154 N 0.82 -0.32 -1.00 2.24 0.00 -1.92 -2.73 119.26 116.35 1ztt h ALA 154 Ca -0.64 -0.01 0.09 0.00 0.00 0.00 0.00 54.91 54.34 1ztt h ALA 154 Cb 1.38 0.37 -0.07 0.00 0.00 0.00 0.00 17.79 19.47 1ztt h ALA 154 CO 0.66 -0.73 0.64 0.74 0.00 0.00 0.00 179.25 180.56 1ztt h PHE 155 N -0.37 1.17 0.00 0.00 0.04 -1.89 -0.55 116.94 115.33 1ztt h PHE 155 Ca 0.05 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.85 1ztt h PHE 155 Cb 0.43 -0.38 0.00 0.00 2.20 0.00 0.00 35.95 38.20 1ztt h PHE 155 CO -0.24 0.56 0.00 0.74 -0.60 0.00 0.00 178.31 178.77 1ztt h PHE 156 N 1.10 0.00 0.00 -0.55 0.04 -1.59 -1.73 116.94 114.21 1ztt h PHE 156 Ca 0.45 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.22 1ztt h PHE 156 Cb 0.29 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.44 1ztt h PHE 156 CO -0.00 0.00 0.00 0.00 -0.60 0.00 0.00 178.31 177.71 1ztt s LEU 158 N -5.64 4.11 0.57 0.00 1.43 -0.65 -0.04 118.68 118.45 1ztt s LEU 158 Ca 0.06 0.21 -0.18 0.00 -1.03 0.00 0.00 54.13 53.18 1ztt s LEU 158 Cb 0.08 -2.44 -0.05 0.00 0.03 0.00 0.00 46.19 43.82 1ztt s LEU 158 CO 0.58 -0.23 1.11 -0.13 0.23 0.00 0.00 176.35 177.91 1ztt s ARG 159 N 2.10 3.28 -0.11 1.70 0.52 -1.26 -0.74 118.95 124.43 1ztt s ARG 159 Ca 0.15 1.52 -0.03 0.00 -0.52 0.00 0.00 55.73 56.85 1ztt s ARG 159 Cb -0.16 -2.00 -0.03 0.00 0.52 0.00 0.00 34.95 33.28 1ztt s ARG 159 CO 0.10 -0.89 0.00 -0.51 0.02 0.00 0.00 175.30 174.02 1ztt s LEU 160 N -4.04 3.55 0.39 2.53 1.43 0.61 -1.29 118.68 121.86 1ztt s LEU 160 Ca 0.70 0.08 -0.27 0.00 -1.03 0.00 0.00 54.13 53.62 1ztt s LEU 160 Cb -0.22 -1.83 -0.09 0.00 0.03 0.00 0.00 46.19 44.08 1ztt s LEU 160 CO 0.30 0.31 1.31 -2.28 0.23 0.00 0.00 176.35 176.22 1ztt s HIS 161 N -0.47 2.86 0.49 0.29 5.65 0.92 -4.66 115.29 120.37 1ztt s HIS 161 Ca 0.08 1.40 0.28 0.00 0.25 0.00 0.00 55.06 57.07 1ztt s HIS 161 Cb -0.12 -3.69 1.36 0.00 -1.18 0.00 0.00 32.58 28.95 1ztt s HIS 161 CO 0.02 -2.08 1.85 -1.35 -0.65 0.00 0.00 174.74 172.53 1ztt h PRO 162 N 2.85 0.14 0.00 2.88 0.11 -1.95 0.55 132.00 136.58 1ztt h PRO 162 Ca -0.49 -0.01 -0.08 0.00 0.11 0.00 0.00 66.00 65.53 1ztt h PRO 162 Cb 1.24 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 1ztt h PRO 162 CO 0.63 0.09 -0.36 1.15 -0.21 0.00 0.00 178.00 179.30 1ztt h THR 163 N 0.14 1.23 0.00 -1.15 2.02 -1.93 -3.03 112.91 110.19 1ztt h THR 163 Ca 0.48 -1.25 0.00 0.00 0.77 0.00 0.00 66.41 66.42 1ztt h THR 163 Cb 1.66 1.68 0.00 0.00 -1.74 0.00 0.00 68.15 69.74 1ztt h THR 163 CO -0.08 0.35 -0.95 -1.20 0.37 0.00 0.00 175.52 174.00 1ztt n SER 164 N -4.07 0.63 -0.31 4.18 7.64 0.13 -4.42 113.62 117.40 1ztt n SER 164 Ca -0.02 -0.24 -0.01 0.00 1.01 0.00 0.00 58.87 59.61 1ztt n SER 164 Cb 0.40 0.72 0.12 0.00 -1.01 0.00 0.00 64.21 64.44 1ztt n SER 164 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 1ztt h GLN 165 N 0.00 1.00 -0.17 1.43 4.20 -1.28 -2.65 115.11 117.63 1ztt h GLN 165 Ca 0.00 -0.06 0.05 0.00 0.06 0.00 0.00 58.65 58.70 1ztt h GLN 165 Cb 0.69 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 28.24 1ztt h GLN 165 CO 0.00 0.66 0.18 -1.35 -0.67 0.00 0.00 178.83 177.65 1ztt h PRO 166 N 1.03 0.00 -0.82 1.46 0.11 -1.77 -2.69 132.00 129.31 1ztt h PRO 166 Ca 0.35 0.00 0.11 0.00 0.11 0.00 0.00 66.00 66.56 1ztt h PRO 166 Cb 0.06 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 31.11 1ztt h PRO 166 CO -0.13 0.00 0.54 1.25 -0.21 0.00 0.00 178.00 179.44 1ztt h LEU 167 N 0.00 0.67 -3.75 2.35 5.85 -1.76 -2.93 115.31 115.74 1ztt h LEU 167 Ca 0.08 0.02 -0.23 0.00 0.84 0.00 0.00 57.88 58.59 1ztt h LEU 167 Cb 0.44 -0.12 -0.14 0.00 0.37 0.00 0.00 40.66 41.21 1ztt h LEU 167 CO -0.00 0.39 0.29 0.49 -0.34 0.00 0.00 178.44 179.27 1ztt n PHE 168 N -4.52 2.52 -2.08 1.25 3.72 -1.01 -4.71 117.46 112.63 1ztt n PHE 168 Ca 0.14 -1.22 -0.34 0.00 -0.05 0.00 0.00 57.45 55.98 1ztt n PHE 168 Cb 0.35 -0.71 0.02 0.00 -0.94 0.00 0.00 39.48 38.20 1ztt n PHE 168 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1ztt s ALA 169 N -2.99 2.61 0.16 4.37 0.00 -1.11 -4.46 121.76 120.35 1ztt s ALA 169 Ca 0.55 0.74 -0.09 0.00 0.00 0.00 0.00 51.96 53.17 1ztt s ALA 169 Cb 0.44 -3.35 -0.01 0.00 0.00 0.00 0.00 23.12 20.20 1ztt s ALA 169 CO 0.14 -0.96 0.28 -0.59 0.00 0.00 0.00 175.76 174.62 1ztt s PHE 170 N -1.95 0.38 0.24 0.00 -0.71 -0.34 -1.98 117.98 113.62 1ztt s PHE 170 Ca 0.71 -0.75 -0.13 0.00 -1.04 0.00 0.00 56.93 55.72 1ztt s PHE 170 Cb -0.23 -0.06 -0.08 0.00 -1.21 0.00 0.00 43.02 41.44 1ztt s PHE 170 CO 0.32 -0.71 0.62 -2.00 -1.34 0.00 0.00 175.22 172.11 1ztt s GLU 171 N -3.96 3.94 -0.17 1.99 2.12 -1.26 -0.83 118.70 120.52 1ztt s GLU 171 Ca 0.16 0.49 -0.19 0.00 0.36 0.00 0.00 54.97 55.79 1ztt s GLU 171 Cb 0.03 -2.67 0.05 0.00 0.26 0.00 0.00 34.13 31.81 1ztt s GLU 171 CO -0.01 0.31 0.53 -0.46 -0.54 0.00 0.00 175.26 175.09 1ztt s TRP 172 N -1.76 -0.56 0.03 5.30 -0.11 0.37 -4.88 118.94 117.32 1ztt s TRP 172 Ca 0.47 1.31 -0.28 0.00 1.22 0.00 0.00 56.10 58.82 1ztt s TRP 172 Cb -0.12 0.21 0.09 0.00 -1.50 0.00 0.00 33.47 32.15 1ztt s TRP 172 CO 0.20 -0.32 0.93 0.50 -4.62 0.00 0.00 176.95 173.64 1ztt s ARG 173 N 0.02 0.88 -0.00 5.86 6.06 -1.26 -4.24 118.95 126.26 1ztt s ARG 173 Ca -0.02 -0.38 0.07 0.00 -2.50 0.00 0.00 55.73 52.90 1ztt s ARG 173 Cb -0.04 0.37 -0.02 0.00 0.06 0.00 0.00 34.95 35.32 1ztt s ARG 173 CO 0.02 -0.39 -0.23 -0.51 -2.50 0.00 0.00 175.30 171.69 1ztt s ASP 174 N -2.60 2.66 0.31 -2.12 -0.00 -1.26 -4.84 116.67 108.81 1ztt s ASP 174 Ca 0.07 -0.44 0.03 0.00 -0.00 0.00 0.00 52.55 52.22 1ztt s ASP 174 Cb -0.01 -0.28 0.18 0.00 -0.00 0.00 0.00 42.92 42.81 1ztt s ASP 174 CO -0.06 0.26 0.88 -2.65 -0.00 0.00 0.00 175.17 173.60 1ztt n PRO 175 N 2.38 0.03 0.00 8.23 -0.02 -1.26 -2.99 135.00 141.37 1ztt n PRO 175 Ca -0.16 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 61.79 1ztt n PRO 175 Cb 0.52 -2.21 0.00 0.00 -0.02 0.00 0.00 33.50 31.79 1ztt n PRO 175 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1ztt n GLU 176 N -1.78 0.00 -0.47 -0.52 -0.00 -1.26 -4.93 120.64 111.69 1ztt n GLU 176 Ca -0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 57.16 57.15 1ztt n GLU 176 Cb 0.62 0.00 -0.01 0.00 -0.00 0.00 0.00 31.44 32.05 1ztt n GLU 176 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1ztt n MET 177 N 0.00 0.93 -1.18 3.44 0.00 -1.26 -4.92 117.12 114.13 1ztt n MET 177 Ca 0.00 -0.08 -0.33 0.00 0.00 0.00 0.00 57.70 57.29 1ztt n MET 177 Cb 0.00 -1.16 0.11 0.00 0.00 0.00 0.00 33.22 32.18 1ztt n MET 177 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 1ztt s GLY 178 N 2.01 2.03 0.71 3.17 0.00 -1.16 -4.82 107.32 109.26 1ztt s GLY 178 Ca 0.05 0.69 -0.17 0.00 0.00 0.00 0.00 44.72 45.29 1ztt s GLY 178 CO 0.00 1.09 0.07 1.39 0.00 0.00 0.00 173.10 175.64 1ztt n ILE 179 N -3.31 0.85 -0.24 0.90 -0.00 -1.26 -4.64 119.36 111.67 1ztt n ILE 179 Ca 0.12 -0.45 -0.07 0.00 -0.00 0.00 0.00 62.75 62.35 1ztt n ILE 179 Cb 0.51 -0.36 -0.06 0.00 -0.00 0.00 0.00 39.64 39.73 1ztt n ILE 179 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.55 176.83 1ztt h SER 180 N -0.39 -1.34 0.00 4.38 0.02 -1.92 -3.43 113.55 110.87 1ztt h SER 180 Ca -0.44 0.20 0.00 0.00 -0.84 0.00 0.00 61.79 60.71 1ztt h SER 180 Cb 1.37 0.59 0.00 0.00 0.14 0.00 0.00 62.40 64.50 1ztt h SER 180 CO 0.38 -0.16 0.00 0.61 -1.14 0.00 0.00 176.83 176.52 1ztt n GLY 181 N -1.17 -1.98 3.88 -3.77 0.00 -1.26 -5.03 105.19 95.86 1ztt n GLY 181 Ca 0.01 0.58 -0.27 0.00 0.00 0.00 0.00 46.02 46.34 1ztt n GLY 181 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ztt s GLN 182 N -0.44 3.20 0.09 1.61 -0.21 -1.24 -0.48 119.66 122.19 1ztt s GLN 182 Ca 0.00 -0.69 0.04 0.00 0.02 0.00 0.00 55.36 54.74 1ztt s GLN 182 Cb 0.00 -2.84 -0.03 0.00 1.00 0.00 0.00 33.01 31.14 1ztt s GLN 182 CO 0.00 0.52 -0.11 -0.51 -2.12 0.00 0.00 175.29 173.07 1ztt s LEU 183 N -3.04 2.38 0.24 2.90 1.43 -0.01 -1.46 118.68 121.11 1ztt s LEU 183 Ca 0.33 -0.77 -0.06 0.00 -1.03 0.00 0.00 54.13 52.60 1ztt s LEU 183 Cb -0.11 -0.37 -0.02 0.00 0.03 0.00 0.00 46.19 45.72 1ztt s LEU 183 CO 0.26 -0.21 0.32 0.28 0.23 0.00 0.00 176.35 177.23 1ztt s THR 184 N -2.15 0.00 0.11 5.49 -1.32 -0.14 -1.20 115.64 116.43 1ztt s THR 184 Ca 0.04 -1.70 -0.17 0.00 -1.21 0.00 0.00 61.69 58.65 1ztt s THR 184 Cb -0.05 -2.38 -0.07 0.00 -1.51 0.00 0.00 72.50 68.50 1ztt s THR 184 CO 0.01 0.00 0.56 0.26 -2.21 0.00 0.00 174.62 173.24 1ztt s TRP 185 N -3.98 3.70 -1.94 9.09 0.52 -1.26 -1.44 118.94 123.62 1ztt s TRP 185 Ca 0.31 1.17 0.16 0.00 0.02 0.00 0.00 56.10 57.75 1ztt s TRP 185 Cb 0.03 -2.43 0.12 0.00 -1.15 0.00 0.00 33.47 30.04 1ztt s TRP 185 CO 0.12 0.51 0.99 0.25 0.02 0.00 0.00 176.95 178.84 1ztt n THR 186 N 1.26 0.00 -4.32 2.01 -2.24 -0.43 -4.68 114.28 105.89 1ztt n THR 186 Ca -0.08 -0.50 -0.17 0.00 -2.27 0.00 0.00 64.05 61.03 1ztt n THR 186 Cb 0.51 1.32 -0.10 0.00 -2.10 0.00 0.00 70.33 69.97 1ztt n THR 186 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1ztt s ARG 187 N -1.30 1.26 -0.09 -0.78 1.81 -1.26 -0.29 118.95 118.31 1ztt s ARG 187 Ca 0.18 -1.57 -0.35 0.00 -1.72 0.00 0.00 55.73 52.28 1ztt s ARG 187 Cb 0.13 -0.89 -0.12 0.00 -0.45 0.00 0.00 34.95 33.62 1ztt s ARG 187 CO 0.19 0.10 1.86 -0.11 -0.68 0.00 0.00 175.30 176.66 1ztt n LEU 188 N -0.34 3.36 -4.90 2.53 7.94 0.08 -4.72 117.00 120.94 1ztt n LEU 188 Ca -0.08 0.99 -0.28 0.00 -1.11 0.00 0.00 56.01 55.53 1ztt n LEU 188 Cb 0.61 -1.36 -0.01 0.00 0.53 0.00 0.00 43.42 43.19 1ztt n LEU 188 CO 0.35 -0.09 0.38 -2.16 -1.11 0.00 0.00 177.39 174.75 1ztt s PRO 189 N 3.86 3.59 0.54 1.96 0.04 -1.26 -3.82 135.00 139.91 1ztt s PRO 189 Ca 0.92 0.16 -0.19 0.00 0.04 0.00 0.00 61.00 61.93 1ztt s PRO 189 Cb -0.71 -2.45 -0.06 0.00 0.04 0.00 0.00 34.50 31.32 1ztt s PRO 189 CO 0.52 -0.07 1.09 -0.65 0.04 0.00 0.00 177.00 177.92 1ztt s GLN 190 N -4.37 3.43 0.00 4.56 -1.52 -1.26 -3.37 119.66 117.13 1ztt s GLN 190 Ca 0.47 1.46 0.00 0.00 -1.95 0.00 0.00 55.36 55.34 1ztt s GLN 190 Cb -0.10 -2.03 0.00 0.00 -0.22 0.00 0.00 33.01 30.66 1ztt s GLN 190 CO 0.39 -0.76 0.00 0.41 -0.25 0.00 0.00 175.29 175.08 1ztt n GLY 191 N -0.19 2.10 3.70 3.09 0.00 -1.26 -4.86 105.19 107.77 1ztt n GLY 191 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 1ztt n GLY 191 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1ztt s PHE 192 N -2.88 3.52 0.52 1.61 5.36 -1.22 -4.53 117.98 120.37 1ztt s PHE 192 Ca 0.00 1.27 0.24 0.00 -0.96 0.00 0.00 56.93 57.48 1ztt s PHE 192 Cb 0.00 -2.90 1.35 0.00 -0.34 0.00 0.00 43.02 41.14 1ztt s PHE 192 CO 0.00 -0.04 1.98 1.57 -1.46 0.00 0.00 175.22 177.27 1ztt h LYS 193 N 6.99 0.06 -0.02 10.12 2.10 -1.92 -2.43 116.57 131.46 1ztt h LYS 193 Ca -0.37 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.28 1ztt h LYS 193 Cb 1.18 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 32.49 1ztt h LYS 193 CO 0.78 0.04 -0.09 0.09 -2.00 0.00 0.00 179.45 178.27 1ztt n ASN 194 N -4.39 2.37 -0.10 7.07 3.02 -1.26 -4.54 115.26 117.42 1ztt n ASN 194 Ca 0.11 -1.74 -0.06 0.00 -0.03 0.00 0.00 54.58 52.86 1ztt n ASN 194 Cb 0.61 0.08 0.02 0.00 -0.61 0.00 0.00 39.78 39.88 1ztt n ASN 194 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 1ztt h SER 195 N 3.58 0.06 -0.05 6.41 0.02 -1.74 0.03 113.55 121.85 1ztt h SER 195 Ca 0.00 0.05 0.02 0.00 -0.84 0.00 0.00 61.79 61.02 1ztt h SER 195 Cb 0.81 0.06 -0.03 0.00 0.14 0.00 0.00 62.40 63.39 1ztt h SER 195 CO 0.00 0.07 -0.09 -0.65 -1.14 0.00 0.00 176.83 175.02 1ztt h PRO 196 N 0.22 -0.12 -0.39 3.45 0.11 -1.80 0.23 132.00 133.70 1ztt h PRO 196 Ca 0.17 0.01 -0.03 0.00 0.11 0.00 0.00 66.00 66.25 1ztt h PRO 196 Cb 0.17 0.03 -0.02 0.00 0.11 0.00 0.00 31.00 31.30 1ztt h PRO 196 CO -0.20 -0.08 0.12 1.15 -0.21 0.00 0.00 178.00 178.78 1ztt h THR 197 N -0.12 1.22 -0.53 -1.15 2.02 -1.81 -1.21 112.91 111.31 1ztt h THR 197 Ca 0.05 -0.71 -0.05 0.00 0.77 0.00 0.00 66.41 66.47 1ztt h THR 197 Cb 0.19 0.95 -0.02 0.00 -1.74 0.00 0.00 68.15 67.53 1ztt h THR 197 CO -0.13 0.25 0.13 -0.07 0.37 0.00 0.00 175.52 176.07 1ztt h LEU 198 N 0.48 0.76 -0.23 2.58 3.38 -0.86 -1.03 115.31 120.40 1ztt h LEU 198 Ca 0.12 -0.13 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 1ztt h LEU 198 Cb 0.26 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.81 1ztt h LEU 198 CO -0.00 0.75 -0.15 0.15 0.09 0.00 0.00 178.44 179.27 1ztt h PHE 199 N 0.79 0.59 -0.60 1.13 3.57 -0.73 -1.75 116.94 119.95 1ztt h PHE 199 Ca 0.17 -0.16 0.04 0.00 3.53 0.00 0.00 57.97 61.56 1ztt h PHE 199 Cb 0.29 -0.13 -0.05 0.00 2.79 0.00 0.00 35.95 38.85 1ztt h PHE 199 CO 0.02 0.81 0.33 0.22 -2.23 0.00 0.00 178.31 177.46 1ztt h ASP 200 N 0.20 0.51 -0.56 0.41 3.58 -0.93 -0.44 116.42 119.19 1ztt h ASP 200 Ca 0.04 0.02 -0.10 0.00 0.42 0.00 0.00 57.03 57.41 1ztt h ASP 200 Cb 0.68 -0.08 -0.02 0.00 1.72 0.00 0.00 39.33 41.62 1ztt h ASP 200 CO 0.04 0.34 -0.05 -0.33 -2.88 0.00 0.00 179.24 176.36 1ztt h GLU 201 N 0.64 1.03 -0.35 0.28 5.08 -1.16 -1.78 114.58 118.32 1ztt h GLU 201 Ca 0.26 -0.35 -0.03 0.00 -1.00 0.00 0.00 59.36 58.24 1ztt h GLU 201 Cb 0.12 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 1ztt h GLU 201 CO -0.15 1.04 0.10 0.00 -1.00 0.00 0.00 179.01 179.00 1ztt h ALA 202 N 1.00 0.46 -0.32 3.43 0.00 -0.69 -1.84 119.26 121.30 1ztt h ALA 202 Ca 0.16 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1ztt h ALA 202 Cb 0.61 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 1ztt h ALA 202 CO 0.04 0.11 -0.13 1.25 0.00 0.00 0.00 179.25 180.52 1ztt h LEU 203 N 0.42 0.53 -0.79 0.00 5.85 -1.02 -1.43 115.31 118.87 1ztt h LEU 203 Ca 0.11 -0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.68 1ztt h LEU 203 Cb 0.27 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 41.12 1ztt h LEU 203 CO -0.00 0.69 0.44 0.45 -0.34 0.00 0.00 178.44 179.68 1ztt h HIS 204 N 0.50 1.07 -0.59 1.25 3.86 -1.05 0.18 115.15 120.37 1ztt h HIS 204 Ca 0.09 -0.02 -0.04 0.00 -1.16 0.00 0.00 60.37 59.24 1ztt h HIS 204 Cb 0.52 -0.34 -0.03 0.00 1.06 0.00 0.00 27.41 28.62 1ztt h HIS 204 CO 0.02 0.74 0.22 0.00 0.86 0.00 0.00 177.93 179.77 1ztt h ARG 205 N 1.09 0.89 0.00 2.45 3.08 -0.67 -1.91 114.38 119.30 1ztt h ARG 205 Ca 0.28 -0.17 -0.05 0.00 0.07 0.00 0.00 59.98 60.11 1ztt h ARG 205 Cb 0.01 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 29.92 1ztt h ARG 205 CO -0.05 0.77 -0.23 -0.44 -1.07 0.00 0.00 179.97 178.96 1ztt h ASP 206 N 0.81 0.00 -0.29 7.04 3.32 -0.65 -3.18 116.42 123.48 1ztt h ASP 206 Ca 0.19 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.24 1ztt h ASP 206 Cb 0.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.78 1ztt h ASP 206 CO -0.01 0.23 0.00 0.18 -1.72 0.00 0.00 179.24 177.91 1ztt n LEU 207 N -3.32 3.25 -0.12 1.55 4.77 0.56 -4.52 117.00 119.17 1ztt n LEU 207 Ca 0.01 -1.38 -0.05 0.00 -0.03 0.00 0.00 56.01 54.55 1ztt n LEU 207 Cb 0.47 -0.18 0.03 0.00 -2.33 0.00 0.00 43.42 41.41 1ztt n LEU 207 CO 0.34 0.67 0.95 0.00 -1.33 0.00 0.00 177.39 178.01 1ztt h ALA 208 N 4.27 0.47 -0.67 -1.18 0.00 -1.32 -2.19 119.26 118.63 1ztt h ALA 208 Ca 0.00 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1ztt h ALA 208 Cb 0.94 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.73 1ztt h ALA 208 CO 0.00 -0.25 0.28 0.22 0.00 0.00 0.00 179.25 179.50 1ztt h ASP 209 N 0.30 0.91 -0.71 0.00 3.58 -1.82 -2.37 116.42 116.31 1ztt h ASP 209 Ca 0.18 -0.16 0.05 0.00 0.42 0.00 0.00 57.03 57.52 1ztt h ASP 209 Cb 0.16 -0.23 -0.05 0.00 1.72 0.00 0.00 39.33 40.93 1ztt h ASP 209 CO -0.19 0.82 0.42 0.15 -2.88 0.00 0.00 179.24 177.56 1ztt h PHE 210 N 0.94 0.78 -0.88 0.28 3.04 -1.75 0.54 116.94 119.90 1ztt h PHE 210 Ca 0.22 0.02 0.00 0.00 3.98 0.00 0.00 57.97 62.20 1ztt h PHE 210 Cb 0.18 -0.25 -0.04 0.00 2.56 0.00 0.00 35.95 38.40 1ztt h PHE 210 CO 0.01 0.40 0.56 0.00 -2.02 0.00 0.00 178.31 177.26 1ztt h ARG 211 N 0.79 1.17 -0.32 1.11 3.08 -1.05 -1.22 114.38 117.93 1ztt h ARG 211 Ca 0.30 -0.09 -0.13 0.00 0.07 0.00 0.00 59.98 60.14 1ztt h ARG 211 Cb 0.12 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 29.91 1ztt h ARG 211 CO -0.15 0.79 -0.34 0.82 -1.07 0.00 0.00 179.97 180.03 1ztt h ILE 212 N 1.20 1.28 0.00 2.04 2.04 -0.70 -2.97 117.51 120.40 1ztt h ILE 212 Ca 0.32 -1.48 0.00 0.00 1.00 0.00 0.00 64.86 64.69 1ztt h ILE 212 Cb -0.10 1.39 0.00 0.00 -0.74 0.00 0.00 36.82 37.38 1ztt h ILE 212 CO -0.06 0.48 0.00 0.00 0.00 0.00 0.00 178.15 178.57 1ztt n GLN 213 N -4.06 0.24 -3.24 2.37 1.13 0.05 -4.11 117.38 109.76 1ztt n GLN 213 Ca -0.01 0.27 -0.24 0.00 -1.94 0.00 0.00 57.00 55.07 1ztt n GLN 213 Cb 0.49 -1.82 -0.07 0.00 0.11 0.00 0.00 30.24 28.96 1ztt n GLN 213 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 1ztt n HIS 214 N -2.25 1.13 0.23 1.08 8.25 -0.51 -4.96 115.22 118.20 1ztt n HIS 214 Ca 0.05 -3.79 0.11 0.00 -0.26 0.00 0.00 57.72 53.83 1ztt n HIS 214 Cb 0.38 -0.43 0.70 0.00 1.12 0.00 0.00 29.99 31.76 1ztt n HIS 214 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1ztt h PRO 215 N 3.88 0.00 -0.00 -0.41 0.11 -1.70 -2.42 132.00 131.46 1ztt h PRO 215 Ca 0.11 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.22 1ztt h PRO 215 Cb 0.80 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.91 1ztt h PRO 215 CO 0.60 0.00 -0.07 -0.25 -0.21 0.00 0.00 178.00 178.06 1ztt n ASP 216 N -4.38 0.50 -4.88 -2.05 10.43 -1.26 -4.85 116.55 110.05 1ztt n ASP 216 Ca -0.01 -0.74 -0.30 0.00 2.57 0.00 0.00 54.79 56.31 1ztt n ASP 216 Cb 0.16 -0.06 -0.05 0.00 1.84 0.00 0.00 41.12 43.02 1ztt n ASP 216 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 1ztt s LEU 217 N -2.34 4.18 -0.18 0.64 1.43 -0.91 -4.71 118.68 116.78 1ztt s LEU 217 Ca 0.33 0.16 -0.05 0.00 -1.03 0.00 0.00 54.13 53.54 1ztt s LEU 217 Cb 0.20 -2.80 -0.03 0.00 0.03 0.00 0.00 46.19 43.60 1ztt s LEU 217 CO 0.44 0.15 -0.01 -0.63 0.23 0.00 0.00 176.35 176.53 1ztt s ILE 218 N -1.52 4.01 -0.18 -0.59 -1.09 -0.50 -4.97 121.20 116.35 1ztt s ILE 218 Ca 0.33 -0.30 0.01 0.00 -2.23 0.00 0.00 60.65 58.45 1ztt s ILE 218 Cb -0.12 -2.79 0.04 0.00 -1.58 0.00 0.00 42.46 38.00 1ztt s ILE 218 CO 0.26 0.46 -0.11 -0.22 -1.23 0.00 0.00 174.94 174.09 1ztt s LEU 219 N 0.69 2.07 -0.17 2.97 2.96 -1.26 -0.32 118.68 125.62 1ztt s LEU 219 Ca -0.01 -0.75 -0.06 0.00 -0.22 0.00 0.00 54.13 53.09 1ztt s LEU 219 Cb -0.14 -1.21 -0.04 0.00 0.50 0.00 0.00 46.19 45.30 1ztt s LEU 219 CO 0.02 -0.12 0.04 -0.76 -1.32 0.00 0.00 176.35 174.21 1ztt s LEU 220 N 1.43 3.68 -0.10 -0.68 1.43 0.09 -4.98 118.68 119.55 1ztt s LEU 220 Ca 0.01 0.04 0.04 0.00 -1.03 0.00 0.00 54.13 53.19 1ztt s LEU 220 Cb -0.15 -1.91 0.00 0.00 0.03 0.00 0.00 46.19 44.16 1ztt s LEU 220 CO -0.09 0.19 -0.22 -1.10 0.23 0.00 0.00 176.35 175.36 1ztt s GLN 221 N 0.26 2.88 -0.46 1.70 -0.21 -1.26 -1.41 119.66 121.16 1ztt s GLN 221 Ca 0.02 -0.82 0.03 0.00 0.02 0.00 0.00 55.36 54.61 1ztt s GLN 221 Cb -0.13 -2.20 0.16 0.00 1.00 0.00 0.00 33.01 31.84 1ztt s GLN 221 CO 0.01 0.14 0.32 -0.47 -2.12 0.00 0.00 175.29 173.17 1ztt s TYR 222 N 0.43 1.70 0.00 0.91 5.04 -0.48 -4.89 117.35 120.05 1ztt s TYR 222 Ca -0.17 -2.41 0.00 0.00 -2.44 0.00 0.00 57.07 52.05 1ztt s TYR 222 Cb -0.18 -1.49 0.00 0.00 0.35 0.00 0.00 41.96 40.65 1ztt s TYR 222 CO 0.07 -0.77 0.00 0.28 -1.34 0.00 0.00 175.55 173.80 1ztt n VAL 223 N 3.09 0.00 -0.13 3.14 0.31 -1.26 -1.38 118.33 122.10 1ztt n VAL 223 Ca 0.19 0.00 0.12 0.00 -0.01 0.00 0.00 64.34 64.64 1ztt n VAL 223 Cb 0.40 0.00 0.30 0.00 -0.91 0.00 0.00 33.84 33.63 1ztt n VAL 223 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1ztt n ASP 224 N 11.07 3.72 -4.34 4.52 5.75 -1.26 -4.74 116.55 131.26 1ztt n ASP 224 Ca 0.00 -2.00 -0.36 0.00 -0.01 0.00 0.00 54.79 52.42 1ztt n ASP 224 Cb 0.00 -0.42 -0.13 0.00 -1.03 0.00 0.00 41.12 39.54 1ztt n ASP 224 CO 0.00 0.00 0.00 -1.81 -0.11 0.00 0.00 177.20 175.28 1ztt s ASP 225 N -1.11 4.90 0.00 -1.12 1.01 -0.48 -0.71 116.67 119.16 1ztt s ASP 225 Ca 0.46 -0.58 0.04 0.00 0.71 0.00 0.00 52.55 53.18 1ztt s ASP 225 Cb 0.24 -1.84 -0.03 0.00 1.01 0.00 0.00 42.92 42.30 1ztt s ASP 225 CO 0.32 -0.13 -0.11 -0.76 0.21 0.00 0.00 175.17 174.70 1ztt s LEU 226 N 1.50 2.93 -0.09 1.23 1.43 0.40 -1.38 118.68 124.70 1ztt s LEU 226 Ca 0.04 -0.23 0.01 0.00 -1.03 0.00 0.00 54.13 52.91 1ztt s LEU 226 Cb -0.16 -1.68 0.02 0.00 0.03 0.00 0.00 46.19 44.40 1ztt s LEU 226 CO 0.01 0.29 -0.09 -0.22 0.23 0.00 0.00 176.35 176.57 1ztt s LEU 227 N -1.28 1.32 -0.13 1.79 1.98 -0.50 -1.49 118.68 120.37 1ztt s LEU 227 Ca 0.15 -0.28 -0.01 0.00 -2.89 0.00 0.00 54.13 51.11 1ztt s LEU 227 Cb -0.11 -0.79 -0.02 0.00 0.66 0.00 0.00 46.19 45.94 1ztt s LEU 227 CO 0.05 -0.07 -0.11 -0.22 -1.89 0.00 0.00 176.35 174.12 1ztt s LEU 228 N 1.32 2.86 -0.04 -0.68 2.96 0.44 -0.73 118.68 124.81 1ztt s LEU 228 Ca -0.03 -0.26 0.05 0.00 -0.22 0.00 0.00 54.13 53.67 1ztt s LEU 228 Cb -0.14 -1.65 -0.01 0.00 0.50 0.00 0.00 46.19 44.89 1ztt s LEU 228 CO -0.04 0.18 -0.18 0.00 -1.32 0.00 0.00 176.35 175.00 1ztt s ALA 229 N 0.25 1.55 0.23 5.97 0.00 0.56 -1.27 121.76 129.05 1ztt s ALA 229 Ca -0.07 -0.73 0.04 0.00 0.00 0.00 0.00 51.96 51.19 1ztt s ALA 229 Cb -0.15 -0.48 -0.05 0.00 0.00 0.00 0.00 23.12 22.44 1ztt s ALA 229 CO 0.05 0.31 -0.01 0.00 0.00 0.00 0.00 175.76 176.10 1ztt s ALA 230 N -0.09 1.84 -0.63 0.00 0.00 0.24 -1.41 121.76 121.71 1ztt s ALA 230 Ca -0.01 -1.77 0.25 0.00 0.00 0.00 0.00 51.96 50.43 1ztt s ALA 230 Cb -0.10 0.46 0.57 0.00 0.00 0.00 0.00 23.12 24.05 1ztt s ALA 230 CO 0.01 -0.24 1.60 1.79 0.00 0.00 0.00 175.76 178.93 1ztt h THR 231 N 2.47 0.00 -3.83 0.00 1.35 -1.84 -2.04 112.91 109.01 1ztt h THR 231 Ca -0.38 -0.61 -0.09 0.00 -0.55 0.00 0.00 66.41 64.77 1ztt h THR 231 Cb 1.22 1.49 -0.13 0.00 -1.73 0.00 0.00 68.15 69.00 1ztt h THR 231 CO 0.65 0.00 -0.34 -0.94 -0.25 0.00 0.00 175.52 174.64 1ztt s SER 232 N -4.84 0.07 0.17 5.36 1.04 -1.26 -4.72 113.70 109.52 1ztt s SER 232 Ca 0.08 -0.74 -0.14 0.00 0.48 0.00 0.00 55.95 55.62 1ztt s SER 232 Cb 0.11 0.39 0.06 0.00 0.10 0.00 0.00 66.02 66.67 1ztt s SER 232 CO 0.65 -0.81 1.82 -0.08 0.98 0.00 0.00 173.24 175.80 1ztt h GLU 233 N 2.64 0.68 -0.14 4.02 4.81 -1.95 -1.21 114.58 123.42 1ztt h GLU 233 Ca -0.33 -0.05 0.01 0.00 -0.13 0.00 0.00 59.36 58.87 1ztt h GLU 233 Cb 1.21 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.43 1ztt h GLU 233 CO 0.52 0.47 0.04 1.25 -0.73 0.00 0.00 179.01 180.56 1ztt h LEU 234 N 0.69 0.04 -1.27 1.64 5.85 -1.99 0.76 115.31 121.03 1ztt h LEU 234 Ca 0.19 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.91 1ztt h LEU 234 Cb -0.06 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 40.96 1ztt h LEU 234 CO -0.04 0.05 0.35 0.44 -0.34 0.00 0.00 178.44 178.90 1ztt h ASP 235 N 0.11 0.75 -0.16 1.25 3.45 -1.92 -0.36 116.42 119.54 1ztt h ASP 235 Ca 0.06 -0.05 -0.14 0.00 0.43 0.00 0.00 57.03 57.33 1ztt h ASP 235 Cb 0.04 -0.19 -0.01 0.00 -0.56 0.00 0.00 39.33 38.61 1ztt h ASP 235 CO -0.06 0.60 -0.39 0.00 -1.57 0.00 0.00 179.24 177.81 1ztt h GLN 237 N 0.57 0.20 -0.49 0.00 4.20 -0.04 0.13 115.11 119.69 1ztt h GLN 237 Ca 0.05 -0.05 -0.11 0.00 0.06 0.00 0.00 58.65 58.60 1ztt h GLN 237 Cb 0.92 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.66 1ztt h GLN 237 CO 0.08 0.37 -0.14 1.96 -0.67 0.00 0.00 178.83 180.43 1ztt h GLN 238 N 0.00 0.93 -0.54 1.46 4.20 -1.03 -1.79 115.11 118.34 1ztt h GLN 238 Ca 0.04 -0.35 -0.11 0.00 0.06 0.00 0.00 58.65 58.29 1ztt h GLN 238 Cb 0.26 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.96 1ztt h GLN 238 CO 0.00 1.01 -0.11 0.78 -0.67 0.00 0.00 178.83 179.84 1ztt h GLY 239 N 0.94 1.10 1.23 3.46 0.00 -0.73 -2.09 103.07 106.99 1ztt h GLY 239 Ca 0.13 -0.89 -0.10 0.00 0.00 0.00 0.00 47.33 46.47 1ztt h GLY 239 CO 0.05 0.81 -0.08 -0.84 0.00 0.00 0.00 176.54 176.48 1ztt h THR 240 N 0.91 1.26 -0.28 4.70 2.02 -0.58 -0.23 112.91 120.71 1ztt h THR 240 Ca 0.14 -1.19 -0.01 0.00 0.77 0.00 0.00 66.41 66.12 1ztt h THR 240 Cb 0.67 0.96 -0.01 0.00 -1.74 0.00 0.00 68.15 68.03 1ztt h THR 240 CO 0.05 0.42 0.15 0.03 0.37 0.00 0.00 175.52 176.54 1ztt h ARG 241 N 0.83 0.40 -0.64 6.66 3.08 -1.15 -0.75 114.38 122.80 1ztt h ARG 241 Ca 0.14 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 60.11 1ztt h ARG 241 Cb 0.61 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.55 1ztt h ARG 241 CO 0.04 0.36 0.30 0.00 -1.07 0.00 0.00 179.97 179.59 1ztt h ALA 242 N 1.02 0.82 -0.36 0.04 0.00 -1.11 -0.68 119.26 118.99 1ztt h ALA 242 Ca 0.10 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 1ztt h ALA 242 Cb 0.08 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1ztt h ALA 242 CO -0.01 0.40 0.01 1.25 0.00 0.00 0.00 179.25 180.89 1ztt h LEU 243 N 0.88 0.61 -0.54 0.00 5.85 -0.85 -0.15 115.31 121.11 1ztt h LEU 243 Ca 0.22 -0.30 -0.03 0.00 0.84 0.00 0.00 57.88 58.61 1ztt h LEU 243 Cb 0.13 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 40.98 1ztt h LEU 243 CO -0.03 0.76 0.23 -0.07 -0.34 0.00 0.00 178.44 179.00 1ztt h LEU 244 N 0.44 0.74 -0.38 2.25 3.38 -1.02 0.15 115.31 120.87 1ztt h LEU 244 Ca 0.10 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1ztt h LEU 244 Cb 0.44 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 1ztt h LEU 244 CO 0.02 0.70 0.25 -0.61 0.09 0.00 0.00 178.44 178.88 1ztt h GLN 245 N 0.74 0.51 -0.30 1.13 5.75 -0.94 -1.55 115.11 120.45 1ztt h GLN 245 Ca 0.18 -0.04 -0.03 0.00 -0.15 0.00 0.00 58.65 58.62 1ztt h GLN 245 Cb 0.18 -0.11 -0.01 0.00 1.07 0.00 0.00 27.48 28.60 1ztt h GLN 245 CO -0.02 0.35 0.08 1.15 -2.65 0.00 0.00 178.83 177.74 1ztt h THR 246 N 0.51 1.21 -0.38 2.39 2.02 -0.73 -1.94 112.91 116.01 1ztt h THR 246 Ca 0.14 -0.70 0.01 0.00 0.77 0.00 0.00 66.41 66.62 1ztt h THR 246 Cb -0.04 1.10 -0.02 0.00 -1.74 0.00 0.00 68.15 67.45 1ztt h THR 246 CO -0.03 0.23 0.24 -0.07 0.37 0.00 0.00 175.52 176.26 1ztt h LEU 247 N 0.33 0.40 -0.66 2.58 3.38 -0.55 -1.15 115.31 119.63 1ztt h LEU 247 Ca 0.10 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 1ztt h LEU 247 Cb 0.28 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.91 1ztt h LEU 247 CO -0.00 0.29 0.29 1.23 0.09 0.00 0.00 178.44 180.34 1ztt h GLY 248 N 0.48 1.04 1.30 0.83 0.00 -1.23 -0.49 103.07 105.01 1ztt h GLY 248 Ca 0.14 -0.55 -0.05 0.00 0.00 0.00 0.00 47.33 46.87 1ztt h GLY 248 CO -0.05 0.52 0.14 -0.57 0.00 0.00 0.00 176.54 176.58 1ztt h ASN 249 N 0.92 0.82 1.14 0.19 -1.24 -1.10 -2.27 115.58 114.04 1ztt h ASN 249 Ca 0.22 -0.15 0.00 0.00 0.71 0.00 0.00 56.30 57.09 1ztt h ASN 249 Cb 0.17 -0.21 0.00 0.00 0.73 0.00 0.00 38.32 39.00 1ztt h ASN 249 CO -0.02 0.80 0.00 -0.07 -1.29 0.00 0.00 177.43 176.84 1ztt h LEU 250 N 0.84 0.00 0.00 0.34 3.38 -0.91 -3.47 115.31 115.49 1ztt h LEU 250 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1ztt h LEU 250 Cb 0.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1ztt h LEU 250 CO -0.00 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.14 1ztt n GLY 251 N 0.60 1.05 3.94 0.83 0.00 -0.85 -2.76 105.19 108.00 1ztt n GLY 251 Ca 0.03 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.82 1ztt n GLY 251 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ztt s TYR 252 N -2.00 3.37 -0.04 1.61 2.02 -0.25 -0.46 117.35 121.60 1ztt s TYR 252 Ca 0.00 0.36 -0.01 0.00 -0.37 0.00 0.00 57.07 57.05 1ztt s TYR 252 Cb 0.00 -2.16 0.03 0.00 -0.40 0.00 0.00 41.96 39.43 1ztt s TYR 252 CO 0.00 -0.17 0.02 1.03 -1.57 0.00 0.00 175.55 174.86 1ztt s ARG 253 N -4.49 0.21 0.15 -0.62 1.81 -1.26 -4.04 118.95 110.70 1ztt s ARG 253 Ca 0.45 0.19 0.01 0.00 -1.72 0.00 0.00 55.73 54.66 1ztt s ARG 253 Cb -0.10 -0.56 -0.04 0.00 -0.45 0.00 0.00 34.95 33.80 1ztt s ARG 253 CO 0.38 -0.23 0.31 0.00 -0.68 0.00 0.00 175.30 175.08 1ztt s ALA 254 N 1.57 3.93 -0.40 2.13 0.00 0.18 0.46 121.76 129.62 1ztt s ALA 254 Ca -0.02 -0.92 -0.28 0.00 0.00 0.00 0.00 51.96 50.73 1ztt s ALA 254 Cb -0.13 -1.87 0.02 0.00 0.00 0.00 0.00 23.12 21.15 1ztt s ALA 254 CO -0.03 0.56 1.08 0.45 0.00 0.00 0.00 175.76 177.82 1ztt s SER 255 N -3.06 6.75 0.23 0.00 0.15 -0.47 -0.47 113.70 116.83 1ztt s SER 255 Ca 0.36 0.70 0.03 0.00 0.70 0.00 0.00 55.95 57.73 1ztt s SER 255 Cb -0.11 -2.53 0.25 0.00 -1.71 0.00 0.00 66.02 61.91 1ztt s SER 255 CO 0.28 -1.05 1.57 0.00 1.20 0.00 0.00 173.24 175.25 1ztt h ALA 256 N 8.67 0.85 -0.90 5.45 0.00 -1.94 -2.39 119.26 129.01 1ztt h ALA 256 Ca -0.22 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 54.18 1ztt h ALA 256 Cb 1.06 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.72 1ztt h ALA 256 CO 1.07 0.69 0.57 -0.22 0.00 0.00 0.00 179.25 181.35 1ztt h LYS 257 N 0.26 1.20 -0.01 0.00 3.11 -2.00 -3.01 116.57 116.11 1ztt h LYS 257 Ca 0.00 -0.09 0.00 0.00 -2.81 0.00 0.00 60.65 57.75 1ztt h LYS 257 Cb 1.05 -0.26 0.00 0.00 -1.00 0.00 0.00 32.23 32.01 1ztt h LYS 257 CO 0.09 0.82 -0.42 1.63 -2.81 0.00 0.00 179.45 178.76 1ztt n LYS 258 N -4.38 1.20 -1.77 1.90 5.02 -1.19 -5.00 118.16 113.95 1ztt n LYS 258 Ca 0.10 -0.96 -0.41 0.00 -2.02 0.00 0.00 58.31 55.02 1ztt n LYS 258 Cb 0.04 -1.48 -0.01 0.00 -0.02 0.00 0.00 35.03 33.57 1ztt n LYS 258 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ztt n ALA 259 N -0.07 2.44 -3.99 7.82 0.00 -0.90 -4.93 120.51 120.88 1ztt n ALA 259 Ca 0.10 0.35 -0.32 0.00 0.00 0.00 0.00 53.44 53.57 1ztt n ALA 259 Cb 0.45 -2.44 -0.15 0.00 0.00 0.00 0.00 19.45 17.32 1ztt n ALA 259 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1ztt s GLN 260 N -1.60 1.94 -0.22 0.00 -0.21 -0.77 -5.01 119.66 113.81 1ztt s GLN 260 Ca 0.57 -1.58 -0.07 0.00 0.02 0.00 0.00 55.36 54.29 1ztt s GLN 260 Cb -0.48 -3.09 -0.03 0.00 1.00 0.00 0.00 33.01 30.41 1ztt s GLN 260 CO 0.59 -0.75 0.06 0.42 -2.12 0.00 0.00 175.29 173.49 1ztt s ILE 261 N 1.04 4.50 -1.04 1.08 1.01 -1.26 -0.48 121.20 126.05 1ztt s ILE 261 Ca 0.00 -0.12 -0.18 0.00 0.00 0.00 0.00 60.65 60.35 1ztt s ILE 261 Cb -0.20 -3.06 0.01 0.00 0.01 0.00 0.00 42.46 39.22 1ztt s ILE 261 CO -0.06 0.40 0.70 0.00 0.00 0.00 0.00 174.94 175.98 1ztt s GLN 263 N -5.88 1.53 0.00 0.00 -1.52 0.52 -4.85 119.66 109.46 1ztt s GLN 263 Ca 0.31 -1.41 0.27 0.00 -1.95 0.00 0.00 55.36 52.58 1ztt s GLN 263 Cb -0.14 -1.91 0.85 0.00 -0.22 0.00 0.00 33.01 31.58 1ztt s GLN 263 CO 0.89 0.43 1.62 1.63 -0.25 0.00 0.00 175.29 179.62 1ztt n LYS 264 N 0.56 1.44 -3.69 2.91 5.02 -1.26 -0.72 118.16 122.41 1ztt n LYS 264 Ca -0.15 -0.89 -0.21 0.00 -2.02 0.00 0.00 58.31 55.04 1ztt n LYS 264 Cb 0.54 -1.48 -0.18 0.00 -0.02 0.00 0.00 35.03 33.89 1ztt n LYS 264 CO 0.00 0.00 0.00 -1.14 -0.52 0.00 0.00 177.40 175.74 1ztt s GLN 265 N -2.18 0.09 0.06 1.97 0.74 -1.26 -4.48 119.66 114.59 1ztt s GLN 265 Ca 0.32 0.29 -0.05 0.00 0.05 0.00 0.00 55.36 55.97 1ztt s GLN 265 Cb 0.20 -0.69 -0.02 0.00 1.10 0.00 0.00 33.01 33.60 1ztt s GLN 265 CO 0.40 -0.34 0.08 0.14 -0.55 0.00 0.00 175.29 175.02 1ztt s VAL 266 N 2.12 0.16 -0.26 1.34 -7.23 -1.03 -4.99 120.40 110.51 1ztt s VAL 266 Ca 0.05 -1.34 -0.10 0.00 -1.81 0.00 0.00 61.98 58.78 1ztt s VAL 266 Cb -0.12 -1.20 -0.05 0.00 0.56 0.00 0.00 36.38 35.57 1ztt s VAL 266 CO -0.04 -0.74 0.17 -0.54 -0.31 0.00 0.00 175.10 173.64 1ztt s LYS 267 N -3.35 3.96 -0.05 4.82 1.02 -1.26 -0.20 119.74 124.69 1ztt s LYS 267 Ca 0.01 -0.32 -0.02 0.00 0.02 0.00 0.00 55.97 55.66 1ztt s LYS 267 Cb 0.03 -3.58 0.04 0.00 -0.52 0.00 0.00 37.83 33.79 1ztt s LYS 267 CO -0.08 -0.10 0.09 -0.47 -0.92 0.00 0.00 175.35 173.87 1ztt s TYR 268 N 1.51 -0.04 -1.52 3.18 5.04 0.37 -4.89 117.35 121.01 1ztt s TYR 268 Ca 0.07 0.34 -0.12 0.00 -2.44 0.00 0.00 57.07 54.92 1ztt s TYR 268 Cb -0.15 -0.30 0.08 0.00 0.35 0.00 0.00 41.96 41.94 1ztt s TYR 268 CO 0.08 -0.18 0.92 1.28 -1.34 0.00 0.00 175.55 176.32 1ztt n LEU 269 N 4.81 -2.54 0.00 6.97 4.77 -1.26 -1.15 117.00 128.60 1ztt n LEU 269 Ca -0.14 -0.81 0.00 0.00 -0.03 0.00 0.00 56.01 55.03 1ztt n LEU 269 Cb 0.50 -2.53 0.00 0.00 -2.33 0.00 0.00 43.42 39.07 1ztt n LEU 269 CO 0.12 0.45 0.00 0.61 -1.33 0.00 0.00 177.39 177.24 1ztt n GLY 270 N -1.67 2.36 3.88 -0.72 0.00 -1.26 -5.02 105.19 102.76 1ztt n GLY 270 Ca -0.01 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 1ztt n GLY 270 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ztt s TYR 271 N -2.97 3.34 -0.32 1.61 1.51 -0.30 -5.08 117.35 115.14 1ztt s TYR 271 Ca 0.00 0.07 -0.07 0.00 -1.01 0.00 0.00 57.07 56.06 1ztt s TYR 271 Cb 0.00 -1.61 0.03 0.00 -0.11 0.00 0.00 41.96 40.27 1ztt s TYR 271 CO 0.00 0.52 0.09 -1.17 -1.11 0.00 0.00 175.55 173.88 1ztt s LEU 272 N -3.11 4.10 -0.38 -1.29 2.96 -1.26 -0.48 118.68 119.22 1ztt s LEU 272 Ca 0.33 -0.94 -0.23 0.00 -0.22 0.00 0.00 54.13 53.07 1ztt s LEU 272 Cb -0.11 -1.87 0.01 0.00 0.50 0.00 0.00 46.19 44.72 1ztt s LEU 272 CO 0.26 -0.26 0.80 -0.76 -1.32 0.00 0.00 176.35 175.06 1ztt s LEU 273 N 1.45 4.13 -0.14 -0.68 1.43 0.72 -4.68 118.68 120.92 1ztt s LEU 273 Ca 0.00 0.30 -0.10 0.00 -1.03 0.00 0.00 54.13 53.30 1ztt s LEU 273 Cb -0.18 -3.04 0.04 0.00 0.03 0.00 0.00 46.19 43.04 1ztt s LEU 273 CO 0.03 -0.77 0.35 -0.75 0.23 0.00 0.00 176.35 175.43 1ztt s LYS 274 N 3.17 0.37 -1.63 1.70 2.20 -1.19 -2.46 119.74 121.90 1ztt s LYS 274 Ca 0.32 0.56 -0.17 0.00 -0.36 0.00 0.00 55.97 56.33 1ztt s LYS 274 Cb -0.13 0.09 0.13 0.00 -1.51 0.00 0.00 37.83 36.41 1ztt s LYS 274 CO 0.18 -0.09 0.88 0.39 -0.36 0.00 0.00 175.35 176.34 1ztt n GLU 275 N 3.45 -4.20 -0.90 4.03 1.02 -1.26 0.53 120.64 123.31 1ztt n GLU 275 Ca -0.18 0.47 0.00 0.00 -0.02 0.00 0.00 57.16 57.44 1ztt n GLU 275 Cb 0.56 -5.27 0.00 0.00 -0.02 0.00 0.00 31.44 26.71 1ztt n GLU 275 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ztt n GLY 276 N -1.52 0.25 3.84 0.62 0.00 -1.26 -4.97 105.19 102.14 1ztt n GLY 276 Ca 0.06 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.74 1ztt n GLY 276 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ztt s GLN 277 N -1.05 4.02 0.00 1.61 1.11 0.19 -4.99 119.66 120.54 1ztt s GLN 277 Ca 0.00 0.59 0.00 0.00 0.01 0.00 0.00 55.36 55.96 1ztt s GLN 277 Cb 0.00 -2.71 0.00 0.00 -1.01 0.00 0.00 33.01 29.29 1ztt s GLN 277 CO 0.00 0.33 0.00 0.54 0.01 0.00 0.00 175.29 176.17